3-Ethyl-5-phenyl-1,2-oxazole-4-carboxylic acid
[CAS# 91569-54-9]

Identification

• Name: 3-Ethyl-5-phenyl-1,2-oxazole-4-carboxylic acid
• Synonyms: 3-ethyl-5-phenylisoxazole-4-carboxylic acid
• Molecular Formula: C₁₂H₁₁NO₃
• Molecular Weight: 217.22
• CAS Registry Number: 91569-54-9
• SMILES: CCc1c(c(on1)c2ccccc2)C(=O)O
• InChI: 1S/C12H11NO3/c1-2-9-10(12(14)15)11(16-13-9)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,14,15)
• InChIKey: PRYKGZVEXSTAGZ-UHFFFAOYSA-N

Properties

• Density: 1.234g/cm³ (Cal.)
• Boiling point: 361.45°C at 760 mmHg (Cal.)
• Flash point: 172.399°C (Cal.)