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Substance Name: 1,3-Dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one
RN: 2898-08-0
InChIKey: IVUAAOBNUNMJQC-UHFFFAOYSA-N

Molecular Formula

  • C15-H12-N2-O

Molecular Weight

  • 236.2728
 
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Names and Synonyms

Synonym

  • EINECS 220-781-3

Systematic Name

  • 1,3-Dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one

Registry Numbers

CAS Registry Number

  • 2898-08-0

System Generated Number

  • 0002898080

Structure Descriptors

InChI

1S/C15H12N2O/c18-14-10-16-15(11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-14/h1-9H,10H2,(H,17,18)

InChIKey

IVUAAOBNUNMJQC-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2=NCC(=O)Nc3c2cccc3

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.18 (none)   EXP
Water Solubility 387 mg/L 25 EST
Vapor Pressure 2.36E-08 mm Hg 25 EST
Henry's Law Constant 2.40E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.99E-11 cm3/molecule-sec 25 EST

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