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Product name

CAS

Formula

Kepone

CAS143-50-0

FormulaC10Cl10O

SynonymChlordecone, 1,3,4-Metheno-2H-cyclobuta[cd]pentalen-2-one, 1,1a,3,3a,4,5,5,5a,5b,6-decachlorooctahydro-, Clordecone, Compound 1189, Decachloroketone, Decachlorooctahydro-1,3,4-metheno-2H-cyclobuta[cd]pentalin-2-one, Decachloropentacyclo[5.2.1.0(2,6).0(3,9).0(5,8)]decan-4-one, ENT-16391, GC 1189, Merex, Decachlorpentacyclo (5.2.1.0(2,6).0(3,9).0(5,8)) decan-4-one, Chlorodecone, Ciba 8514, Kepone-2-one, decachlorooctahydro-, NCI-C00191, 1,2,3,5,6,7,8,9,10,10-Decachloro(5.2.1.0(2,6).0(3,9) .0(5,8))decan-4-one, 1,3,4-Metheno-2H-cyclobuta(cd)pentalen-2-one, 1,1a,3,3a,4,5,5,5a,5b,6-decachloroctahydro-, Decachloro-1,3,4-metheno-2H-cyclobuta(cd)pentalen-2-one, Decachlorooctahydro-1,3,4-metheno-2H-cyclobuta(cd)pentalen-2-one, 1,1a,3,3a,4,5,5,5a,5b,6-Decachlorooctahydro-1,3,4-metheno-2H-cyclobuta(cd)pentalen-2-one, Decachloropentacyclo(5.3.0.0(2,6).0(4,10).0(5,9))decan-3-one, Decachlorotetracyclodecanone, ENT 16,391, General chemicals 1189, Rcra waste number U142, NSC 124074, Kepone, Chlordecone, 1,1a,3,3a,4,5,5,5a,5b,6-Decachloroctahydro-1,3,4-metheno-2H-cyclobuta(cd)-pentalen-2-one, Decachloroketone, Decachloro-1,3,4-metheno-2H-cyclobuta(cd)pentalen-2-one, Decachlorooctahydrokepone-2-one Decachlorooctahydro-1,3,4-metheno-2H-cyclobuta(cd)pentalen-2-one, Decachlorotetracyclodecanone, Decachlorotetrahydro-4,7-methanoideneone

Molecular weight490.64

InChI1S/C10Cl10O/c11-2-1(21)3(12)6(15)4(2,13)8(17)5(2,14)7(3,16)9(6,18)10(8,19)20

Water solubility2.7 mg/L

Vapor Pressure2.25E-07 mm Hg

Atmospheric OH Rate Constant0.0 cm3/molecule-sec

Melting Point350 dec ° C

log P (octanol-water)5.41

Henry's Law Constant5.38E-08 atm-m3/mole

Urea, 3-(Beta-Chloroethyl)-1-(4-Methylcyclohexyl)-3-Nitroso-

CAS13909-09-6

FormulaC10H18ClN3O2

SynonymUrea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, ICIG 1110, Me-CCNU, Methyl-CCNU, NSC 95441, 1-(2-Chloroethyl)-3-(4-methyl-cyclohexyl)-1-nitrosourea, N-(2-Chloroethyl)-N'-(4-methylcyclohexyl)-N-nitrosourea, Lomustine, methyl-, NCI-C04955, 1-(2-Chloroethyl)-1-([(4-methylcyclohexyl)amino]carbonyl)-2-oxohydrazine, Urea, 3-(beta-chloroethyl)-1-(4-methylcyclohexyl)-3-nitroso-, 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, CCRIS 6336, HSDB 7760, ICIG 1110, Lomustine, methyl-, Methyl-CCNU, N-(2-Chloroethyl)-N'-(trans-4-methylcyclohexyl)-N-nitrosourea, NCI-C04955, NSC 95441, Semustina, Semustina [INN-Spanish], Semustine, Semustinum, Semustinum [INN-Latin], UNII-6YY7T1T567, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, trans-, N-(2-Chloroethyl)-N'-(4-methylcyclohexyl)-N-nitrosourea, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, Urea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, Superlist Names 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea [Chloroethyl nitrosoureas], MeCCNU, Methyl-CCNU, Methyl-CCNU [Chloroethyl nitrosoureas]

Molecular weight247.72

SMILESC1(NC(N(CCCl)N=O)=O)CCC(C)CC1

InChI1S/C10H18ClN3O2/c1-8-2-4-9(5-3-8)12-10(15)14(13-16)7-6-11/h8-9H,2-7H2,1H3,(H,12,15)

Henry's Law Constant2.46E-10 atm-m3/mole

Water solubility37 mg/L

Atmospheric OH Rate Constant2.36E-11 cm3/molecule-sec

Vapor Pressure5.61E-06 mm Hg

log P (octanol-water)3.3

Desmedipham

CAS13684-56-5

FormulaC16H16N2O4

SynonymCarbamic acid, [3-[[(phenylamino)carbonyl]oxy]phenyl]-, ethyl ester, Carbanilic acid, m-hydroxy-, ethyl ester, carbanilate (ester), Ethyl m-hydroxycarbanilate carbanilate, Ethyl N-[3-(N-phenylcarbamoyloxy)phenyl]carbamate, EP 475, 3-Ethoxycarbonylaminophenyl N-phenylcarbamate, Carbamic acid, phenylcarbamoyloxyphenyl-, ethyl ester, 3-(Aethoxycarbonylaminophenyl)-N-phenyl-carbamat, Bentanex, Betanal AM, Betanex, Carbanilic acid, m-carbaniloyloxy-, ethyl ester, Ethyl phenylcarbamoyloxyphenylcarbamate, Schering 38107, SN 38107, Synbetan D, Ethyl [3-[[(phenylamino)carbonyl]oxy]phenylcarbamate, 3-((Ethoxycarbonyl)amino)phenyl phenylcarbamate, 3-(Aethoxycarbonylaminophenyl)-N-phenyl-carbamat, 3-(Aethoxycarbonylaminophenyl)-N-phenyl-carbamat [German], 3-Ethoxycarbonylaminophenyl-N-phenylcarbamate, Bentanex, Betanal AM, Betanal AM 11, Betanex, BRN 2395716, Carbamic acid, (3-(((phenylamino)carbonyl)oxy)phenyl)-, ethyl ester (9CI), Carbanilic acid, m-carbaniloyloxy-, ethyl ester, Carbanilic acid, m-hydroxy-, ethyl ester, carbanilate (ester) (8CI), Caswell No. 447AAA, CCRIS 9306, Desmedipham, Desmediphame, Desmediphame [ISO-French], EINECS 237-198-5, EP-475, EPA Pesticide Chemical Code 104801, Ethyl (3-(((phenylamino)carbonyl)oxy)phenyl)carbamate (9CI), Ethyl 3'-phenylcarbamoyloxycarbanilate, Ethyl 3-phenylcarbamoyloxyphenylcarbamate, Ethyl m-hydroxycarbanilate carbanilate (ester), Ethyl phenylcarbamoyloxyphenylcarbamate, Schering 38107, SN 38107, SN 38170, SN 475, Synbetan D, UNII-C7V2TTX346, Carbamic acid, (3-(((phenylamino)carbonyl)oxy)phenyl)-, ethyl ester, Carbamic acid, (3-(((phenylamino)carbonyl)oxy)phenyl)-, ethyl ester (9CI), Carbamic acid, phenylcarbamoyloxyphenyl-, ethyl ester, Carbanilic acid, m-hydroxy-, ethyl ester, carbanilate (ester) (8CI), Desmedipham, Superlist Names Desmedipham, Ethyl meta-hydroxycarbanilate carbanilate

Molecular weight300.31

SMILESc1c(OC(Nc2ccccc2)=O)cccc1NC(OCC)=O

InChI1S/C16H16N2O4/c1-2-21-15(19)18-13-9-6-10-14(11-13)22-16(20)17-12-7-4-3-5-8-12/h3-11H,2H2,1H3,(H,17,20)(H,18,19)

Henry's Law Constant1.69E-10 atm-m3/mole

Melting Point120 ° C

log P (octanol-water)3.39

Atmospheric OH Rate Constant9.13E-11 cm3/molecule-sec

Vapor Pressure3.00E-09 mm Hg

pKa Dissociation Constant12.9

Water solubility7 mg/L

Distannoxane, Hexakis(2-Methyl-2-Phenylpropyl)-

CAS13356-08-6

Synonymbendex, bis(tris(beta,beta-dimethylphenethyl)tin)oxide, di(tri-(2,2-dimethyl-2-phenylethyl)tin)oxide, Distannoxane,hexakis(2-methyl-2-phenylpropyl)-, ent27738, fenbutatin, fenbutatin-oxyde, fenylbutatinoxide, Fenbutatin oxide, 2-(Methyl-2-phenylpropyl)distannoxane, AI3-27738, Bendex, Bis(trineophyltin) oxide, Bis(tris(2-methyl-2-phenylpropyl)tin) oxide, Bis(tris(2-methyl-2-phenylpropyl)tin)oxide, Bis(tris(beta,beta-dimethylphenethyl)tin)oxide, BRN 4097400, Caswell No. 481DD, Di(tri-(2,2-dimethyl-2-phenylethyl)tin)oxide, EINECS 236-407-7, ENT 27738, EPA Pesticide Chemical Code 104601, Fenbutatin oxide, Fenbutatin-oxyde, Fenbutatin-oxyde [ISO-French], Fenylbutatin oxide, Fenylbutylstannium oxide, Fenylbutylstannium oxide [Czech], Hexakis, Hexakis (2-methyl-2-phenylpropyl)-distannoxane, Hexakis(2-methyl-2-phenylpropyl)distannoxane, Hexakis(beta,beta-dimethylphenethyl)-distannoxane, HSDB 6632, Neostanox, Neostanox [ISO:PROP], Osdaran, SD 14114, Shell SD-14114, Torque, UNII-ZSV4C2L4E7, Vendex, Bis(tris(2-methyl-2-phenylpropyl)tin) oxide, Distannoxane, 1,1,1,3,3,3-hexakis(2-methyl-2-phenylpropyl)-, Distannoxane, hexakis(2-methyl-2-phenylpropyl)-, Distannoxane, hexakis(beta,beta-dimethylphenethyl)-, Hexakis(2-methyl-2-phenylpropyl)distannoxane, Superlist Names Bis(tris(2-methyl-2-phenylpropyl)tin)oxide, Fenbutatin oxide, Fenbutatin-oxide, Hexakis(2-methyl-2-phenylpropyl)distannoxane

Molecular weight1,052.68

EINECS236-407-7

SMILESCC(C)(C[Sn](CC(C)(C)c1ccccc1)(CC(C)(C)c2ccccc2)O[Sn](CC(C)(C)c3ccccc3)(CC(C)(C)c4ccccc4)CC(C)(C)c5ccccc5)c6ccccc6

Water solubility0.0127 mg/L

Melting Point138 ° C

Henry's Law Constant0.028 atm-m3/mole

Atmospheric OH Rate Constant6.08E-10 cm3/molecule-sec

Vapor Pressure1.80E-11 mm Hg

Thorium Dioxide

CAS1314-20-1

FormulaO2Th

SynonymThO2, Thoria, thorianite, Thorium anhydride, Thorium oxide (ThO2), Thorium(IV), thoriumanhydride, thoriumoxide(tho2), THORIUM OXIDE, EINECS 215-225-1, HSDB 6364, Thoria, Thorianite, Thorium anhydride, Thorium dioxide, Thorium oxide, Thorium oxide (ThO2), Thorium-232 dioxide, Thorotrast, Thortrast, Umbrathor, UNII-9XA7X17UQC, Thorium dioxide, Thorium oxide, Thorium oxide (ThO2), Superlist Names Thorium dioxide, Thorium oxide

Molecular weight264.04

EINECS215-225-1

SMILES[Th](=O)=O

Phosphoric Acid, Tris(2,3-Dibromopropyl) Ester

CAS126-72-7

FormulaC9H15Br6O4P

SynonymAnfram 3PB, Apex 462-5, Bromkal P 67-6HP, ES 685, Firemaster LV-T 23P, Firemaster T 23P, Flamex T 23P, Flammex AP, Flammex T 23P, Fyrol HB 32, T 23P, Tris, Tris (Flame retardant), Tris(2,3-dibromopropyl) phosphate, TDBPP, Zetofex ZN, Phosphoric acid tri(2,3-dibromopropyl) ester, (2,3-Dibromopropyl) phosphate, Firemaster t23p-lv, NCI-C03270, Phosphoric acid, tris(2,3-dibromopropyl) ester, Tdbp, Tris(dibromopropyl) phosphate, Tris-Bp, Tris-2,3-dibrompropyl ester kyseliny fosforecne, USAF do-41, 2,3-Dibromo-1-propanol phosphate, Flammex lv-T 23P, Rcra waste number U235, Tris(2,3-dibromopropyl) phosphoric acid ester, Tris-(2,3-dibrompropyl)fosfat, Zetifex zn, 1-Propanol, 2,3-dibromo-, phosphate, FR-2406, TDCPP, Flacavon R, 1-Propanol, 2,3-dibromo-, 1,1',1''-phosphate, 3PBR, FireMaster T 23, NSC 3240, Phoscon PE 60, Phoscon UF-S, 1-Propanol, 2,3-dibromo-, phosphate, 1-Propanol, 2,3-dibromo-, phosphate (3:1), 1-Propanol,2,3-dibromo-,phosphate(3:1), 2,3-dibromo-1-propanolphosphate(3:1), 2,3-dibromo-1-propanophosphate(3:1), 3pbr, Anfram 3PB, anfram3pb, TRIS(2,3-DIBROMOPROPYL)PHOSPHATE, Tris (2,3-dibromopropyl) phosphate, 2,3-Dibromo-1-propanol phosphate, 2,3-Dibromo-1-propanol, phosphate (31), Phosphoric acid, tris (2,3-dibromopropyl) ester, 1-Propanol, 2,3-dibromo-, phosphate, Tris-BP Tris (dibromopropyl) phosphate, Tris (2,3-dibromopropyl) phosphoric acid ester

Molecular weight697.61

EINECS204-799-9

InChI1S/C9H15Br6O4P/c10-1-7(13)4-17-20(16,18-5-8(14)2-11)19-6-9(15)3-12/h7-9H,1-6H2

Henry's Law Constant2.18E-05 atm-m3/mole

Melting Point5.5 ° C

log P (octanol-water)4.29

Atmospheric OH Rate Constant2.77E-11 cm3/molecule-sec

Water solubility8 mg/L

Merck13,9821

Vapor Pressure1.90E-04 mm Hg

4,5-Dichloro-M-Benzenedisulfonamide

CAS120-97-8

FormulaC6H6Cl2N2O4S2

Synonym1,3-Benzenedisulfonamide, 4,5-dichloro-, m-Benzenedisulfonamide, 4,5-dichloro-, CB 8000, Daranide, Dasanide, Dichlofenamide, 4,5-Dichloro-m-benzenedisulfonamide, 4,5-Dichloro-1,3-disulfamoylbenzene, Dichlorophenamide, 3,4-Dichloro-5-sulfamylbenzenesulfonamide, 1,3-Disulfamyl-4,5-dichlorobenzene, Oratrol, Diclofenamide, 4,5-Dichloro-m-benzendisulfonamide, Antidrasi, 1,3-Disulfamoyl-4,5-dichlorobenzene, Glaucol

Molecular weight305.16

InChI1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14)

Nickel Sulfide

CAS12035-72-2

FormulaNi3S2

Molecular weight240.21

Anisindione

CAS117-37-3

FormulaC16H12O3

Synonym1H-Indene-1,3(2H)-dione, 2-(4-methoxyphenyl)-, 1,3-Indandione, 2-(p-methoxyphenyl)-, Anisin indandione, 2-p-Anisyl-1,3-indandione, 2-(p-Methoxyphenyl)-1,3-indandione, 2-(4-Methoxyphenyl)-1H-indene-1,3(2H)-dione, 2-(p-Methoxyphenyl)indane-1,3-dione, Miradon, SPE 2792, Unidone, Andion

Molecular weight252.26

InChI1S/C16H12O3/c1-19-11-8-6-10(7-9-11)14-15(17)12-4-2-3-5-13(12)16(14)18/h2-9,14H,1H3

3,5-Dimethyl-5-Ethyl Oxazolidine-2,4-Dione

CAS115-67-3

FormulaC7H11NO3

Synonym2,4-Oxazolidinedione, 5-ethyl-3,5-dimethyl-, Paradione, Parametadione, A 348, 3,5-Dimethyl-5-ethyloxazolidine-2,4-dione, 5-Ethyl-3,5-dimethyloxazolidine-2,4-dione, Isoethadione, 5-Ethyl-3,5-dimethyl-2,4-oxazolidinedione

Molecular weight157.17

InChI1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3

Bicyclo[2.2.1]-5-Heptene-2,3-Dicarboxylic Acid, 1,4,5,6,7,7-Hexachloro-

CAS115-28-6

FormulaC9H4Cl6O4

Synonym5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, Chlorendic acid, Hexachloroendomethylenetetrahydrophthalic acid, HET acid, Kyselina het, Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-d(4)-tetrahyroftalova, NCI-C55072, Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-d(4)-tetrahydroftalova, Kyselina 1,2,3,4,7,7-hexachlorbicyklo(2,2,1)hept-2-en-5,6-dikarboxylova, Bicyclo[2.2.1]-5-heptene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, 1,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-Hexachlorobicyclo-(2,2,1)hept-5-en-2,3-dicarboxylic acid, 2H,3H-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, NSC 22231, 1,4,5,6,7,7-hexachloro-8,9,10-trinorborn-5-ene-2,3-dicarboxylic acid, Chlorendic acid, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, HET acid, Hexachloro-endo-methylenetetrahydrophthalic acid, 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-

Molecular weight388.84

InChI1S/C9H4Cl6O4/c10-3-4(11)8(13)2(6(18)19)1(5(16)17)7(3,12)9(8,14)15/h1-2H,(H,16,17)(H,18,19)

Water solubility3500 mg/L

Henry's Law Constant1.12E-13 atm-m3/mole

Melting Point209 ° C

log P (octanol-water)3.140

Vapor Pressure3.04E-08 mm Hg

Atmospheric OH Rate Constant8.18E-12 cm3/molecule-sec

Cycloate

CAS1134-23-2

FormulaC11H21NOS

SynonymCycloate

Molecular weight215.36

InChI1S/C11H21NOS/c1-3-12(11(13)14-4-2)10-8-6-5-7-9-10/h10H,3-9H2,1-2H3

Carbamothioic Acid, Butylethyl-, S-Propyl Ester

CAS1114-71-2

FormulaC10H21NOS

SynonymCarbamothioic acid, butylethyl-, S-propyl ester, Tillam, Carbamic acid, butylethylthio-, S-propyl ester, Butylethylthiocarbamic acid S-propyl ester, PEBC, R-2061, S-Propyl butylethylthiocarbamate, Stauffer R-2061, S-Propyl-N-butyl-N-ethylthiocarbamate, S-Propyl-N-aethyl-N-butyl-thiocarbamat, Propyl-ethylbutylthiocarbamate, Propyl ethylbutylthiolcarbamate, n-Propyl N-ethyl-N-(n-butyl)thiocarbamate, Propylethyl-n-butylthiocarbamate, Propyl N-ethyl-N-butylthiocarbamate, S-(n-Propyl)-N-ethyl-N-n-butylthiocarbamate, Tillam-6-E, S-Propyl-N-ethyl-N-butylthiocarbamate, Carbamothioic acid, N-butyl-N-ethyl-, S-propyl ester

Molecular weight203.35

InChI1S/C10H21NOS/c1-4-7-8-11(6-3)10(12)13-9-5-2/h4-9H2,1-3H3

2-Butene, 1,4-Dichloro-, (E)-

CAS110-57-6

FormulaC4H6Cl2

Synonym2-Butene, 1,4-dichloro-, (E)-, (E)-1,4-Dichloro-2-butene, 1,4-Dichloro-trans-2-butene, 2-Butene, 1,4-dichloro-, trans-, 1,4-Dichloro-2-butene, trans, 1,4-Dichloro-(E)-2-butene, 1,4-Dichlorobutene-2, (E)-, trans-2,3-dichlorobut-2-ene

Molecular weight125.00

InChI1S/C4H6Cl2/c5-3-1-2-4-6/h1-2H,3-4H2/b2-1+

N-Nitrosomethylethylamine

CAS10595-95-6

FormulaC3H8N2O

SynonymEthanamine, N-methyl-N-nitroso-, N-Nitrosomethylethylamine, Ethylamine, N-methyl-N-nitroso-, Methylethylnitrosamine, Methylethylnitrosoamine, N-Methyl-N-nitrosoethanamine, N-Methyl-N-nitrosoethylamine, Nitrosomethylethylamine, Methylaethylnitrosamin, N,N-Methylethylnitrosamine, N-Methyl-N-nitroso-ethamine, NEMA, N-Nitrosoethylmethylamine, N-Nitroso-N-methylethylamine, N-NITROSO-METHYL-ETHYLAMINE, 1-Ethyl-1-methyl-2-oxohydrazine, Ethanamine, N-methyl-N-nitroso-, Ethylamine, N-methyl-N-nitroso-, Ethylmethylnitrosamine, Methylaethylnitrosamin, Methylethylnitrosoamine, N,N-Methylethylnitrosamine, N-NITROSO-METHYL-ETHYLAMINE, 4-04-00-03386 (Beilstein Handbook Reference), BRN 1742021, CCRIS 3058, Ethanamine, N-methyl-N-nitroso-, Ethylamine, N-methyl-N-nitroso-, Ethylmethylnitrosamine, HSDB 5109, Methylaethylnitrosamin, Methylaethylnitrosamin [German], Methylethylnitrosamine, Methylethylnitrosoamine, N,N-Methylethylnitrosamine, N-Ethyl-N-methylnitrosamine, N-Methyl-N-nitrosoethanamine, N-Methyl-N-nitrosoethylamine, N-Nitroso-N-methylethylamine, N-Nitrosoethylmethylamine, N-Nitrosomethylethylamine, UNII-00RLM29Y3A, Ethanamine, N-methyl-N-nitroso-, Ethylamine, N-methyl-N-nitroso-, N-Nitrosomethylethylamine, Superlist Names Ethanamine, N-methyl-N-nitroso-, N-Nitrosomethylethylamine

Molecular weight88.11

SMILESN(CC)(N=O)C

InChI1S/C3H8N2O/c1-3-5(2)4-6/h3H2,1-2H3

Atmospheric OH Rate Constant1.00E-11 cm3/molecule-sec

Water solubility3.00E+05 mg/L

Henry's Law Constant1.44E-06 atm-m3/mole

log P (octanol-water)0.04

Boiling Point170 ° C

Vapor Pressure1.100 mm Hg

Fluoranthene, 3,7-Dinitro

CAS105735-71-5

FormulaC16H8N2O4

Synonym3,7-Dinitrofluoranthene, 3,7-dinitrofluoroanthene, 3,7-Dinitrofluoranthene

Molecular weight292.25

InChI1S/C16H8N2O4/c19-17(20)13-8-7-10-9-3-2-6-14(18(21)22)16(9)12-5-1-4-11(13)15(10)12/h1-8H

Benzene, 1,4-Diisocyanato-

CAS104-49-4

FormulaC8H4N2O2

SynonymIsocyanic acid, p-phenylene ester, p-Phenylene diisocyanate, p-Phenylene isocyanate, 1,4-Diisocyanatobenzene, 1,4-Phenylene diisocyanate, Phenylene-1,4-diisocyanate, 1,4-Benzenediisocyanate, BENZENE 1,4-DIISOCYANATE, 1,4-PHENYLENE DIISOCYANATE, 1,4-Benzenediisocyanate, 1,4-diisocyanato-benzen, 1,4-Diisocyanatobenzene, 1,4-diisocyanato-Benzene, benzene,1,4-diisocyanato-, Isocyanic acid, p-phenylene ester, 1,4-Phenylene diisocyanate

Molecular weight160.13

EINECS203-207-6

SMILESO=C=Nc1ccc(cc1)N=C=O

InChI1S/C8H4N2O2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H

Heptachlor Epoxide

CAS1024-57-3

FormulaC10H5Cl7O

Synonym1,4,5,6,7,8,8-Heptachloro-2,3-epoxy-3a,4,7,7a-tetrahydro-4,7-endo-methanoindan, (1aalpha,1bbeta,2alpha,5alpha,5abeta,6beta,6aalpha)-hexahydro, 1,4,5,6,7,8,8-heptachloro-2,3-epoxy-2,3,3a,4,7,7a-hexahydro-4,7-methanoinden, 1,4,5,6,7,8,8-heptachloro-2,3-epoxy-3a,4,7,7a-tetrahydro-4,7-methanoindane, 1,4,5,6,7,8,8-heptachloro-2,3-epoxy-3a,4,7,7a-tetrahydro-7-methanoindan, 2,3,4,5,6,7,7-heptachloro-1a,1b,5,5a,6,6a-hexahydro-2,5-methano-2h-indeno(1,, 2,5-Methano-2H-indeno[1,2-b]oxirene, 2,3,4,5,6,7,7-heptachloro-1a,1b,5,5a,6,6a-hexahydro-, 2,5-Methano-2H-indeno[1,2-b]oxirene, 2,3,4,5,6,7,7-heptachloro-1a,1b,5,5a,6,6a-hexahydro-, (1aalpha,1bbeta,2alpha,5alpha,5abeta,6beta,6aalpha)-, 2,5-methano-2H-indeno[1,2-b]oxirene,2,3,4,5,6,7,7-heptachloro-1a,1b,5,5a,6,6a-hexahydro-,(1aa,1bß,2a,5a,5aß,6ß,6aa)-, CIS-HEPTACHLOREPOXIDE EXO-, ISOMER B

Molecular weight389.32

EINECS213-831-0

InChI1S/C10H5Cl7O/c11-3-1-2(4-5(3)18-4)9(15)7(13)6(12)8(1,14)10(9,16)17/h1-5H

Aniline), Methylene Bis-4,4'-(2-Chloro-

CAS101-14-4

FormulaC13H12Cl2N2

SynonymBenzenamine, 4,4'-methylenebis[2-chloro-, Aniline, 4,4'-methylenebis[2-chloro-, Bis(3-chloro-4-aminophenyl)methane, Bis(4-amino-3-chlorophenyl)methane, Diamet Kh, LD 813, Methylenebis[3-Chloro-4-aminobenzene], MOCA, Quodorole, 3,3'-Dichloro-4,4'-Diaminodiphenylmethane, 4,4'-Methylenebis[o-chloroaniline], 4,4'-Diamino-3,3'-dichlorodiphenyl methane, 2,2'-dichloro-4,4'-methylendianiline, p,p'-Methylenebis(a-chloroaniline), p,p'-Methylenebis(o-chloroaniline), Curalin M, Curene 442, Cyanaset, CL-MDA, Dacpm, Di(4-amino-3-chlorophenyl)methane, Di-(4-amino-3-clorofenil)metano, Methylene-4,4'-bis(o-chloroaniline), MBOCA, MOCA (curing agent), 3,3'-Dichlor-4,4'-diaminodiphenylmethan, 3,3'-Dicloro-4,4'-diaminodifenilmetano, 4,4-Metilene-bis-o-cloroanilina, 4,4'-Methylenebis(2-chlorobenzenamine), Bis-amine A, 3,3'-Dichloro-4,4'-diaminodifenilmetano, Methylene-bis-orthochloroaniline, Rcra waste number U158, Bisamine S, Cuamine M, Cuamine MT, Methylenebis(chloroaniline), Millionate M, Aniline), methylene bis-4,4'-(2-chloro-, METHYLENEBIS(2-CHLOROANILINE), CHEMBRDG-BB 5180272, di(4-amino-3-chlorophenyl)methane, DACPM, CUAMINE-M, CUAMINE-M SOLVENT, BIS-AMINE A, 2,2-DICHLORO-4,4'-METHYLENEDIANILINE, 4,4'-Methylene bis(2-chloroaniline), 4,4´-Methylenebis (2-chloraniline), Di (4-amino-3-chlorophenyl) methane, 4,4-Diamino-3,3-dichlorodiphenylmethane, 3,3-Dichloro-4,4-diaminodiphenylmethane, MBOCA, 4,4-Methylenebis (2-chloroaniline) 4,4-Methylenebis (o-chloroaniline), p,p-Methylenebis (a-chloroaniline), p,p-Methylenebis (o-chloroaniline), 4,4-Methylenebis-2-chlorobenzenamine, MOCA

EINECS202-918-9

Molecular weight267.15

Henry's Law Constant4.06E-11 atm-m3/mole

Melting Point110 ° C

log P (octanol-water)3.91

Boiling Point378.9 ° C

Vapor Pressure2.86E-07 mm Hg

Water solubility13.9 mg/L

Atmospheric OH Rate Constant7.75E-11 cm3/molecule-sec

InChI1S/C13H12Cl2N2/c14-10-6-8(1-3-12(10)16)5-9-2-4-13(17)11(15)7-9/h1-4,6-7H,5,16-17H2

Piperidine, 1-Nitroso-

CAS100-75-4

FormulaC5H10N2O

SynonymPiperidine, 1-nitroso-, 1-Nitrosopiperidine, N-Nitroso-piperidin, Nitrosopiperidin, No-Pip, NPIP, N-N-Pip, Pyridine, hexahydro-N-nitroso-, Rcra waste number U179, N-NITROSOPIPERIDINE, 1-NITROSOPIPERIDINE, 1-nitroso-piperidin, hexahydro-n-nitroso-pyridin, Nitrosopiperidin, N-Nitroso-piperidin, N-N-Pip, No-Pip, N-NITROSOPIPERIDINE

Molecular weight114.15

EINECS202-886-6

InChI1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2

Vinyl Fluoride

CAS75-02-5

FormulaC2H3F

SynonymEthene, fluoro-, Ethylene, fluoro-, Fluoroethene, Fluoroethylene, Monofluoroethylene, C2H3F, 1-Fluoroethylene, FC 1141, Monofluoroethene, 4-01-00-00694 (Beilstein Handbook Reference), BRN 1731574, CCRIS 7213, EC 200-832-6, EINECS 200-832-6, Ethene, fluoro-, Ethylene, fluoro-, Fluoroethene, Fluoroethylene, Fluoroethylene (IUPAC), HSDB 807, Monofluoroethene, Monofluoroethylene, UNII-2598465ICX, Vinyl fluoride, Ethene, fluoro-, Ethylene, fluoro- (8CI), Fluoroethene, Fluoroethylene, Vinyl fluoride, Superlist Names Ethene, fluoro-, Ethylene, fluoro-, UN1860, Vinyl fluoride, Vinyl fluoride, inhibited, Vinyl fluoride, inhibited [UN1860] [Flammable gas]

Molecular weight46.04

SMILESC(=C)F

InChI1S/C2H3F/c1-2-3/h2H,1H2

Atmospheric OH Rate Constant5.56E-12 cm3/molecule-sec

Water solubility1.29E+04 mg/L

Henry's Law Constant0.118 atm-m3/mole

Melting Point-1.61E+02 ° C

log P (octanol-water)1.190

Boiling Point-7.20E+01 ° C

Vapor Pressure1.98E+04 mm Hg

4-Nitrobiphenyl

CAS92-93-3

FormulaC12H9NO2

SynonymBiphenyl, 4-nitro-, 1,1'-Biphenyl, 4-nitro-, p-Nitrobiphenyl, p-Nitrodiphenyl, Ba 2794, 1-Nitro-4-phenylbenzene, 4-Nitrodiphenyl, p-Phenylnitrobenzene, PNB, 4-Phenylnitrobenzene, NSC 1324, 1-Nitro-4-phenylbenzene, 4-nitro-1’-biphenyl, 4-nitro-bipheny, 4-nitrobiphenyle, 4-Nitrodiphenyl, 4-Phenylnitrobenzene, 4-phenyl-nitrobenzene, Ba 2794, 1,1'-Biphenyl, 4-nitro-, 1-Nitro-4-phenylbenzene, 4-Nitro-1,1'-biphenyl, 4-Nitrobiphenyl, 4-Nitrodiphenyl, 4-Phenyl-nitrobenzene, AI3-00635, Ba 2794, Biphenyl, 4-nitro-, CCRIS 443, EINECS 202-204-7, HSDB 2632, NSC 1324, p-Nitrobiphenyl, p-Nitrodiphenyl, p-Phenyl-nitrobenzene, PNB, UNII-QM80NUW6WZ, 1,1'-Biphenyl, 4-nitro-, 4-Nitrobiphenyl, Biphenyl, 4-nitro-, Superlist Names 1,1'-Biphenyl, 4-nitro-, 4-Nitrobiphenyl, 4-Nitrodiphenyl

Molecular weight199.21

EINECS202-204-7

SMILESc1(c2ccccc2)ccc([N+](=O)[O-])cc1

InChI1S/C12H9NO2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H

Melting Point114 ° C

Water solubility1.23 mg/L

Henry's Law Constant3.54E-06 atm-m3/mole

log P (octanol-water)3.82

Atmospheric OH Rate Constant2.92E-12 cm3/molecule-sec

Boiling Point340 ° C

Vapor Pressure3.25E-05 mm Hg

N-Dodecylguanidine Acetate

CAS2439-10-3

FormulaC15H33N3O2; C13H29N3.C2H4O2

Synonym1-Dodecylguanidine acetate, AC 5223(R), MELPREX, MELPREX(R), LAURYLGUANIDINE, LAURYL GUANIDINE ACETATE, DODENE, DODEX, Dodine, 1-Dodecylguanidinium acetate, Aadodin, AC 5223, American cyanamid 5223, Carpene, Caswell No. 419, Curitan, Cyprex, Cyprex 65W, Dodecylguanidine acetate, Dodecylguanidine monoacetate, Dodin, Dodine, Dodine, mixture with glyodin, Doguadine, EINECS 219-459-5, ENT 16,436, EPA Pesticide Chemical Code 044301, Experimental fungicide 5223, Guanidine, dodecyl-, monoacetate, HSDB 1705, Karpen, Kyselina 3-dodecylguanidinooctova, Kyselina 3-dodecylguanidinooctova [Czech], Laurylguanidine acetate, Melprex, Melprex 65, Melprex 65W, Melprex Liquid Dodine, n-Dodecylguanidine acetate, Questuran, Radspor, Syllit, Syllit 65, Tsitrex, UNII-259C423Y98, Venturol, Vondodine, Guanidine, dodecyl-, acetate, Guanidine, dodecyl-, monoacetate, Guanidine, N-dodecyl-, acetate (1:1), Superlist Names Dodecylguanidine monoacetate, Dodine

Molecular weight287.44

EINECS219-459-5

SMILESN(C(=N)N)CCCCCCCCCCCC.C(=O)(C)O

Vapor Pressure1.50E-07 mm Hg

Water solubility630 mg/L

Melting Point136 ° C

pKa Dissociation Constant9

log P (octanol-water)1.15

Atmospheric OH Rate Constant1.09E-10 cm3/molecule-sec

Henry's Law Constant9.01E-11 atm-m3/mole

Storage Temperature0-6°C

Flash Point>100 °C

Merck13,3442

Melting Point136°C

Butadiene

CAS106-99-0

FormulaC4H6

SynonymButadiene, a,?-Butadiene, Biethylene, Bivinyl, Buta-1,3-diene, Divinyl, Erythrene, Pyrrolylene, Vinylethylene, CH2=CHCH=CH2, Butadieen, Buta-1,3-dieen, Butadien, Buta-1,3-dien, NCI-C50602, 1,3-BUTADIENE, DIVINYL, ERYTHRENE, BIETHYLENE, BUDIENE, BUTADIENE, BIVINYL, PYRROLYLENE, 1,3-BUTADIENE, 1,3-Butadiene, Biethylene, Bivinyl, Buta-1,3-diene, a-g-Butadiene, Butadiene monomer Divinyl, Erythrene, Pyrrolylene, Vinylethylene

Molecular weight54.09

EINECS203-450-8

InChI1S/C4H6/c1-3-4-2/h3-4H,1-2H2

Refractive Index1.4292

Melting Point-109 °C

Merck1509

FreezingPoint-108.91?

Boiling Point-4.5 °C

Flash Point-105 °F

Vapor Density1.9 (15 °C, vs air)

Density0.62 g/mL at 20 °C

Vapor Pressure1863 mm Hg ( 21 °C)

Storage Temperature0-6°C

StabilityStable. Extremely flammable. May form explosive mixtures with air. Incompatible with strong oxidizing agents, copper, copper alloys. May contain stabilizer.

Henry's Law Constant0.074 atm-m3/mole

Melting Point-1.09E+02 ° C

log P (octanol-water)1.99

Boiling Point-4.40E+00 ° C

Vapor Pressure2110 mm Hg

Water solubility735 mg/L

Atmospheric OH Rate Constant6.66E-11 cm3/molecule-sec

1,3-Bis(Isocyanatomethyl)Cyclohexane

CAS38661-72-2

FormulaC10H14N2O2

Synonym1,3-bis(isocyanatomethyl)-cyclohexan, 1,3-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, 1,3-Bis(isocyanatomethyl)cyclohexane (cis and trans- mixture), 1,3-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, 99 % (MIXTURE OF CIS AND TRANS), 1,3-BIS(ISOCYANATOMETHYL)CYCLOHEXANEPRE-POLYMER, CYCLOHEXANE,1,3-BIS(ISOCYANATOMETHYL)-, 1,3-BIS(ISOCYANATOMETHYL)CYCLOHEXANE (CIS- AND TRANS- MIXTURE) 98+%, (1,3-Cyclohexanediylbismethylene)bisisocyanate

Molecular weight194.23

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