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1,2-Di-Tert-Butylbenzene

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Product Description

PRODUCT

1,2-Di-Tert-Butylbenzene

CAS #

1012-76-6

FORMULA

C14H22

Typical Product Specifications

MOLECULAR WEIGHT

275.52

EINECS

202-910-5

SMILES

c1(Nc2c(cccc2)Cl)nc(nc(n1)Cl)Cl

INCHI

1S/C9H5Cl3N4/c10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h1-4H,(H,13,14,15,16)

INCHIKEY

IMHBYKMAHXWHRP-UHFFFAOYSA-N

LOG P (OCTANOL-WATER)

3.88

WATER SOLUBILITY

8 mg/L

ATMOSPHERIC OH RATE CONSTANT

4.28E-11 cm3/molecule-sec

VAPOR PRESSURE

6.20E-09 mm Hg

HENRY'S LAW CONSTANT

2.81E-10 atm-m3/mole

MELTING POINT

160 ° C

MOLECULAR WEIGHT

186.17

EINECS

202-928-3

SMILES

O=NN1CN2CN(CN(C2)N=O)C1

INCHI

1S/C5H10N6O2/c12-6-10-2-8-1-9(4-10)5-11(3-8)7-13/h1-5H2

INCHIKEY

MWRWFPQBGSZWNV-UHFFFAOYSA-N

MOLECULAR WEIGHT

258.10

EINECS

202-930-4

SMILES

c1(cc(ccc1)Cl)NC(OCC#CCCl)=O

INCHI

1S/C11H9Cl2NO2/c12-6-1-2-7-16-11(15)14-10-5-3-4-9(13)8-10/h3-5,8H,6-7H2,(H,14,15)

INCHIKEY

MCOQHIWZJUDQIC-UHFFFAOYSA-N

BOILING POINT

224 dec ° C

ATMOSPHERIC OH RATE CONSTANT

5.54E-11 cm3/molecule-sec

HENRY'S LAW CONSTANT

1.17E-08 atm-m3/mole

VAPOR PRESSURE

3.80E-07 mm Hg

MELTING POINT

75 ° C

LOG P (OCTANOL-WATER)

3.410

WATER SOLUBILITY

11 mg/L

MOLECULAR WEIGHT

190.32

MOLECULAR WEIGHT

258.10

EINECS

202-930-4

SMILES

c1(cc(ccc1)Cl)NC(OCC#CCCl)=O

INCHI

1S/C11H9Cl2NO2/c12-6-1-2-7-16-11(15)14-10-5-3-4-9(13)8-10/h3-5,8H,6-7H2,(H,14,15)

INCHIKEY

MCOQHIWZJUDQIC-UHFFFAOYSA-N

BOILING POINT

224 dec ° C

ATMOSPHERIC OH RATE CONSTANT

5.54E-11 cm3/molecule-sec

HENRY'S LAW CONSTANT

1.17E-08 atm-m3/mole

VAPOR PRESSURE

3.80E-07 mm Hg

MELTING POINT

75 ° C

LOG P (OCTANOL-WATER)

3.410

WATER SOLUBILITY

11 mg/L

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