3-Isopropyl-5-phenyl-1,2-oxazole-4-carboxylic acid
[CAS# 92029-27-1]

Identification

• Name: 3-Isopropyl-5-phenyl-1,2-oxazole-4-carboxylic acid
• Synonyms: 3-isopropyl-5-phenylisoxazole-4-carboxylic acid
• Molecular Formula: C₁₃H₁₃NO₃
• Molecular Weight: 231.25
• CAS Registry Number: 92029-27-1
• SMILES: CC(C)c1c(c(on1)c2ccccc2)C(=O)O
• InChI: 1S/C13H13NO3/c1-8(2)11-10(13(15)16)12(17-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,15,16)
• InChIKey: ZRUXRSPPPCWPKP-UHFFFAOYSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 381.727°C at 760 mmHg (Cal.)
• Flash point: 184.662°C (Cal.)