4-Ethyl-1-Phenyl-1H-1,2,3-Triazole-5-Carboxylic Acid
[CAS# 558441-00-2]

Identification

• Name: 4-Ethyl-1-Phenyl-1H-1,2,3-Triazole-5-Carboxylic Acid
• Synonyms: 4-ethyl-1-phenyl-1H-1,2,3-triazole-5-carboxylic acid
• Molecular Formula: C₁₁H₁₁N₃O₂
• Molecular Weight: 217.22
• CAS Registry Number: 558441-00-2
• SMILES: CCc1c(n(nn1)c2ccccc2)C(=O)O
• InChI: 1S/C11H11N3O2/c1-2-9-10(11(15)16)14(13-12-9)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,15,16)
• InChIKey: LVLXNUDGCDGUMH-UHFFFAOYSA-N

Properties

• Density: 1.304g/cm³ (Cal.)
• Boiling point: 421.927°C at 760 mmHg (Cal.)
• Flash point: 208.974°C (Cal.)
• Refractive index: 1.636 (Cal.)