2-Propyn-1-yl 1H-imidazole-1-carboxylate
[CAS# 83395-38-4]

Identification

• Name: 2-Propyn-1-yl 1H-imidazole-1-carboxylate
• Synonyms: prop-2-yn-1-yl 1H-imidazole-1-carboxylate
• Molecular Formula: C₇H₆N₂O₂
• Molecular Weight: 150.13
• CAS Registry Number: 83395-38-4
• SMILES: C#CCOC(=O)n1ccnc1
• InChI: 1S/C7H6N2O2/c1-2-5-11-7(10)9-4-3-8-6-9/h1,3-4,6H,5H2
• InChIKey: LLVCOZOEWQQTAV-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 255.546°C at 760 mmHg (Cal.)
• Flash point: 108.35°C (Cal.)

References

• (1): De Geest Bruno G.. Biodegradable microcapsules designed via ‘click’ chemistry, Chemical Communications, 2008