Methyl 4-(Chlorocarbonyl)-1H-1,2,3-Triazole-5-Carboxylate
[CAS# 488816-89-3]

Identification

• Name: Methyl 4-(Chlorocarbonyl)-1H-1,2,3-Triazole-5-Carboxylate
• Synonyms: methyl 5-(chlorocarbonyl)-2H-1,2,3-triazole-4-carboxylate
• Molecular Formula: C₅H₄ClN₃O₃
• Molecular Weight: 189.56
• CAS Registry Number: 488816-89-3
• SMILES: COC(=O)c1c([nH]nn1)C(=O)Cl
• InChI: 1S/C5H4ClN3O3/c1-12-5(11)3-2(4(6)10)7-9-8-3/h1H3,(H,7,8,9)
• InChIKey: QTWWXVLQFYXVRW-UHFFFAOYSA-N

Properties

• Density: 1.6g/cm³ (Cal.)
• Boiling point: 399.219°C at 760 mmHg (Cal.)
• Flash point: 195.241°C (Cal.)
• Refractive index: 1.57 (Cal.)