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Substance Name: 2-Chlorodiazepam
RN: 2894-68-0
UNII: 070818R7PB
InChIKey: VPAYQWRBBOGGPY-UHFFFAOYSA-N

Molecular Formula

  • C16-H12-Cl2-N2-O

Molecular Weight

  • 319.1898
 
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Names and Synonyms

Results Name

  • 2-Chlorodiazepam

Name of Substance

  • 2-Chlorodiazepam

Synonyms

  • 2'-Chlorodiazepam
  • 2-Chlorodiazepam
  • 7-Chloro-5-(2-chlorophenyl)-1,3-dihydro-1-methyl-2H-1,4-benzodiazepin-2-one
  • Chlorodiazepam
  • Diclazepam
  • HSDB 6959
  • Ro 5-3448
  • UNII-070818R7PB

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1-methyl-

Registry Numbers

CAS Registry Number

  • 2894-68-0

FDA UNII

  • 070818R7PB

System Generated Number

  • 0002894680

Structure Descriptors

InChI

1S/C16H12Cl2N2O/c1-20-14-7-6-10(17)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)18/h2-8H,9H2,1H3

InChIKey

VPAYQWRBBOGGPY-UHFFFAOYSA-N

Smiles

CN1c2ccc(cc2C(=NCC1=O)c3ccccc3Cl)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.12 (none)   EXP
Water Solubility 20.5 mg/L 25 EST
Vapor Pressure 7.59E-09 mm Hg 25 EST
Henry's Law Constant 2.70E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.25E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.