7-Methyl-5-Phenyl-1,3,4,5-Tetrahydro-2H-1,4-Benzodiazepin-2-One
[CAS# 17972-75-7]

Identification

• Name: 7-Methyl-5-Phenyl-1,3,4,5-Tetrahydro-2H-1,4-Benzodiazepin-2-One
• Synonyms: 7-Methyl-5-phenyl-1,3,4,5-tetrahydro-benzo[e][1,4]diazepin-2-one; BAS 00462484; MLS000068870
• Molecular Formula: C₁₆H₁₆N₂O
• Molecular Weight: 252.31
• CAS Registry Number: 17972-75-7
• SMILES: CC1=CC2=C(C=C1)NC(=O)CNC2C3=CC=CC=C3
• InChI: 1S/C16H16N2O/c1-11-7-8-14-13(9-11)16(17-10-15(19)18-14)12-5-3-2-4-6-12/h2-9,16-17H,10H2,1H3,(H,18,19)
• InChIKey: LAMDOHSZMCNSRL-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 429.5±45.0°C at 760 mmHg (Cal.)
• Flash point: 165.9±28.9°C (Cal.)
• Refractive index: 1.583 (Cal.)