C06817

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Product Description

Product
C06817
CAS
28981-97-7
Formula
C17H13ClN4
Synonym
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 4H-s-Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine; D 65MT; U 31889; TUS-1; Xanax; Alplax; Taf

Typical Product Specifications

Molecular weight
308.77
EINECS
249-349-2
SMILES
c12c(C(c3ccccc3)=NCc3n1c(nn3)C)cc(Cl)cc2
InChI
1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3
InChIKey
VREFGVBLTWBCJP-UHFFFAOYSA-N
Vapor Pressure
1.65E-08 mm Hg
Water solubility
13.1 mg/L
Atmospheric OH Rate Constant
7.62E-12 cm3/molecule-sec
Henry's Law Constant
9.77E-12 atm-m3/mole
log P (octanol-water)
2.12
Storage Temperature
2-8°C
Flash Point
11 °C
Solubility
H2O: insoluble
Melting Point
228-228.50C
Class
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C06817
iso certificate
Get a quote

For more information call
phone_icon
(914) 654-6800
or email
mail_icon
INFO@PARCHEM.COM

For more information

Product Description

Product
C06817
CAS
28981-97-7
Formula
C17H13ClN4
Synonym
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 4H-s-Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-1-methyl-6-phenyl-; 8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine; D 65MT; U 31889; TUS-1; Xanax; Alplax; Taf

Typical Product Specifications

Molecular weight
308.77
EINECS
249-349-2
SMILES
c12c(C(c3ccccc3)=NCc3n1c(nn3)C)cc(Cl)cc2
InChI
1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3
InChIKey
VREFGVBLTWBCJP-UHFFFAOYSA-N
Vapor Pressure
1.65E-08 mm Hg
Water solubility
13.1 mg/L
Atmospheric OH Rate Constant
7.62E-12 cm3/molecule-sec
Henry's Law Constant
9.77E-12 atm-m3/mole
log P (octanol-water)
2.12
Storage Temperature
2-8°C
Flash Point
11 °C
Solubility
H2O: insoluble
Melting Point
228-228.50C
Class
Get a quote
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