7-Chloro-1-methyl-5-(²H₅)phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
[CAS# 65854-76-4]

Identification

• Classification: Analytical chemistry >> Standard >> Standard material
• Name: 7-Chloro-1-methyl-5-(²H₅)phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
• Synonyms: Diazepam-D5
• Molecular Formula: C₁₆H₈D₅ClN₂O
• Molecular Weight: 289.77
• CAS Registry Number: 65854-76-4
• SMILES: [2H]c1c(c(c(c(c1[2H])[2H])C2=NCC(=O)N(c3c2cc(cc3)Cl)C)[2H])[2H]
• InChI: 1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3/i2D,3D,4D,5D,6D
• InChIKey: AAOVKJBEBIDNHE-VIQYUKPQSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 497.38°C at 760 mmHg (Cal.)
• Flash point: 254.607°C (Cal.)