Methyl 1-(cyanomethyl)-1H-1,2,4-triazole-5-carboxylate
[CAS# 64074-24-4]

Identification

• Name: Methyl 1-(cyanomethyl)-1H-1,2,4-triazole-5-carboxylate
• Synonyms: methyl 1-(cyanomethyl)-1H-1,2,4-triazole-5-carboxylate
• Molecular Formula: C₆H₆N₄O₂
• Molecular Weight: 166.14
• CAS Registry Number: 64074-24-4
• SMILES: N#CCn1ncnc1C(=O)OC
• InChI: 1S/C6H6N4O2/c1-12-6(11)5-8-4-9-10(5)3-2-7/h4H,3H2,1H3
• InChIKey: GFMVYXOYXNANIG-UHFFFAOYSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 365.625°C at 760 mmHg (Cal.)
• Flash point: 174.924°C (Cal.)