7-Chloro-N-methyl-N-nitroso-5-phenyl-3H-1,4-Benzodiazepin-2-amine 4-oxide
[CAS# 51715-17-4]

Identification

• Name: 7-Chloro-N-methyl-N-nitroso-5-phenyl-3H-1,4-Benzodiazepin-2-amine 4-oxide
• Synonyms: N-(7-Chloro-4-Oxido-5-Phenyl-3H-1,4-Benzodiazepin-4-Ium-2-Yl)-N-Methyl-Nitrous Amide; 3H-1,4-Benzodiazepin-2-Amine, 7-Chloro-N-Methyl-N-Nitroso-5-Phenyl-, 4-Oxide; 5-25-18-00307 (Beilstein Handbook Reference)
• Molecular Formula: C₁₆H₁₃ClN₄O₂
• Molecular Weight: 328.76
• CAS Registry Number: 51715-17-4
• SMILES: C1=CC(=CC2=C1N=C(N(N=O)C)C[N+](=C2C3=CC=CC=C3)[O-])Cl
• InChI: 1S/C16H13ClN4O2/c1-20(19-22)15-10-21(23)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)18-15/h2-9H,10H2,1H3
• InChIKey: VGNMVQBFGJATJZ-UHFFFAOYSA-N

Properties

• Density: 1.378g/cm³ (Cal.)
• Boiling point: 523.785°C at 760 mmHg (Cal.)
• Flash point: 270.576°C (Cal.)