5-Ethoxy-1-Methyl-7-Nitro-3H-1,4-Benzodiazepin-2(1H)-One
[CAS# 62903-64-4]

Identification

• Name: 5-Ethoxy-1-Methyl-7-Nitro-3H-1,4-Benzodiazepin-2(1H)-One
• Synonyms: 3H-1,4-Benzodiazepin-2(1H)-One, 5-Ethoxy-1-Methyl-7-Nitro-; 5-Ethoxy-1-Methyl-7-Nitro-3H-1,4-Benzodiazepin-2(1H)-One; Brn 0687294
• Molecular Formula: C₁₂H₁₃N₃O₄
• Molecular Weight: 263.25
• CAS Registry Number: 62903-64-4
• SMILES: C1=C([N+]([O-])=O)C=CC2=C1C(=NCC(=O)N2C)OCC
• InChI: 1S/C12H13N3O4/c1-3-19-12-9-6-8(15(17)18)4-5-10(9)14(2)11(16)7-13-12/h4-6H,3,7H2,1-2H3
• InChIKey: JLKXQSZBUMAJNW-UHFFFAOYSA-N

Properties

• Density: 1.373g/cm³ (Cal.)
• Boiling point: 533.348°C at 760 mmHg (Cal.)
• Flash point: 276.359°C (Cal.)