Ethyl 3-Nitro-1H-1,2,4-Triazole-1-Carboxylate
[CAS# 328003-44-7]

Identification

• Name: Ethyl 3-Nitro-1H-1,2,4-Triazole-1-Carboxylate
• Synonyms: ethyl 3-nitro-1H-1,2,4-triazole-1-carboxylate
• Molecular Formula: C₅H₆N₄O₄
• Molecular Weight: 186.13
• CAS Registry Number: 328003-44-7
• SMILES: CCOC(=O)n1cnc(n1)[N+](=O)[O-]
• InChI: 1S/C5H6N4O4/c1-2-13-5(10)8-3-6-4(7-8)9(11)12/h3H,2H2,1H3
• InChIKey: GWXQPVCZUNPAME-UHFFFAOYSA-N

Properties

• Density: 1.647g/cm³ (Cal.)
• Boiling point: 374.594°C at 760 mmHg (Cal.)
• Flash point: 180.348°C (Cal.)
• Refractive index: 1.642 (Cal.)