alpha-Methyl-2-[4-(Trifluoromethyl)Phenyl]-5-Benzoxazoleacetic Acid
[CAS# 51234-73-2]

Identification

• Name: alpha-Methyl-2-[4-(Trifluoromethyl)Phenyl]-5-Benzoxazoleacetic Acid
• Synonyms: 2-[2-[4-(Trifluoromethyl)Phenyl]-1,3-Benzoxazol-5-Yl]Propionic Acid; 5-Benzoxazoleacetic Acid, Alpha-Methyl-2-(Alpha,Alpha,Alpha-Trifluoro-P-Tolyl)-; Brn 1089599
• Molecular Formula: C₁₇H₁₂F₃NO₃
• Molecular Weight: 335.28
• CAS Registry Number: 51234-73-2
• SMILES: C1=C(C=CC2=C1N=C(O2)C3=CC=C(C=C3)C(F)(F)F)C(C(O)=O)C
• InChI: 1S/C17H12F3NO3/c1-9(16(22)23)11-4-7-14-13(8-11)21-15(24-14)10-2-5-12(6-3-10)17(18,19)20/h2-9H,1H3,(H,22,23)
• InChIKey: CGOUFDAVNKYPMT-UHFFFAOYSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 422.52°C at 760 mmHg (Cal.)
• Flash point: 209.333°C (Cal.)