Methyl 4-(cyanomethyl)-1H-1,2,3-triazole-5-carboxylate
[CAS# 73591-48-7]

Identification

• Name: Methyl 4-(cyanomethyl)-1H-1,2,3-triazole-5-carboxylate
• Synonyms: methyl 5-(cyanomethyl)-1H-1,2,3-triazole-4-carboxylate
• Molecular Formula: C₆H₆N₄O₂
• Molecular Weight: 166.14
• CAS Registry Number: 73591-48-7
• SMILES: O=C(OC)c1nnnc1CC#N
• InChI: 1S/C6H6N4O2/c1-12-6(11)5-4(2-3-7)8-10-9-5/h2H2,1H3,(H,8,9,10)
• InChIKey: SRCZLVCTJNOADN-UHFFFAOYSA-N

Properties

• Density: 1.404g/cm³ (Cal.)
• Boiling point: 429.848°C at 760 mmHg (Cal.)
• Flash point: 213.765°C (Cal.)