(+)-Hexahydro-2-(Nitroimino)-1H-1,3-Diazepine-4-Carboxylic acid
[CAS# 28958-86-3]

Identification

• Name: (+)-Hexahydro-2-(Nitroimino)-1H-1,3-Diazepine-4-Carboxylic acid
• Synonyms: Oe-78; (+)-Hexahydro-2-(Nitroimino)-1H-1,3-Diazepine-4-Carboxylic Acid; 1H-1,3-Diazepine-4-Carboxylic Acid, Hexahydro-2-(Nitroimino)-, (+)-
• Molecular Formula: C₆H₁₀N₄O₄
• Molecular Weight: 202.17
• CAS Registry Number: 28958-86-3
• SMILES: O=C(O)C1NC(=NCCC1)N[N+]([O-])=O
• InChI: 1S/C6H10N4O4/c11-5(12)4-2-1-3-7-6(8-4)9-10(13)14/h4H,1-3H2,(H,11,12)(H2,7,8,9)
• InChIKey: FJWMOVGCXKOKPT-UHFFFAOYSA-N

Properties

• Density: 1.762g/cm³ (Cal.)
• Boiling point: 426.699°C at 760 mmHg (Cal.)
• Flash point: 211.86°C (Cal.)