5-[4-(Trifluoromethyl)phenyl]-1,2,4-oxadiazole-3-carboxylic acid
[CAS# 652979-81-2]

Identification

• Name: 5-[4-(Trifluoromethyl)phenyl]-1,2,4-oxadiazole-3-carboxylic acid
• Synonyms: 1,2,4-Oxadiazole-3-carboxylic acid, 5-[4-(trifluoromethyl)phenyl]-; 5-(4-(Trifluoromethyl)phenyl)-1,2,4-oxadiazole-3-carboxylicacid; 5-[4-(Trifluormethyl)phenyl]-1,2,4-oxadiazol-3-carbonsäure
• Molecular Formula: C₁₀H₅F₃N₂O₃
• Molecular Weight: 258.15
• CAS Registry Number: 652979-81-2
• SMILES: c1cc(ccc1c2nc(no2)C(=O)O)C(F)(F)F
• InChI: 1S/C10H5F3N2O3/c11-10(12,13)6-3-1-5(2-4-6)8-14-7(9(16)17)15-18-8/h1-4H,(H,16,17)
• InChIKey: LBJNGVILZFVSFL-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 383.0±52.0°C at 760 mmHg (Cal.)
• Flash point: 185.4±30.7°C (Cal.)
• Refractive index: 1.515 (Cal.)