3-Amino-7-Chloro-5-Phenyl-1,3-Dihydro-Benzo[e][1,4]Diazepin-2-One
[CAS 894-77-9]

Identification

• Name: 3-Amino-7-Chloro-5-Phenyl-1,3-Dihydro-Benzo[e][1,4]Diazepin-2-One
• Synonyms: Brn 0754064; 1,3-Dihydro-3-Amino-7-Chloro-5-Phenyl-2H-1,4-Benzodiazepin-2-One; 2H-1,4-Benzodiazepin-2-One, 1,3-Dihydro-3-Amino-7-Chloro-5-Phenyl-
• Molecular Formula: C₁₅H₁₂ClN₃O
• Molecular Weight: 285.73
• CAS Registry Number: 894-77-9
• SMILES: C1=C(Cl)C=CC2=C1C(=NC(N)C(N2)=O)C3=CC=CC=C3
• InChI: 1S/C15H12ClN3O/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)19-14(17)15(20)18-12/h1-8,14H,17H2,(H,18,20)
• InChIKey: TUINAAYXMRLCEA-UHFFFAOYSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 484.393°C at 760 mmHg (Cal.)
• Flash point: 246.752°C (Cal.)