ethyl 3-[4-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-5-carboxylate
[CAS# 851224-80-1]

Identification

• Name: ethyl 3-[4-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-5-carboxylate
• Synonyms: 1,2,4-Thiadiazole-5-carboxylicacid,3-[4-(trifluoromethyl)phenyl]-,ethylester
• Molecular Formula: C₁₂H₉F₃N₂O₂S
• Molecular Weight: 302.27
• CAS Registry Number: 851224-80-1
• SMILES: FC(F)(F)c1ccc(cc1)c2nc(sn2)C(=O)OCC
• InChI: 1S/C12H9F3N2O2S/c1-2-19-11(18)10-16-9(17-20-10)7-3-5-8(6-4-7)12(13,14)15/h3-6H,2H2,1H3
• InChIKey: OZPIJQDPXKMQHJ-UHFFFAOYSA-N

Properties

• Density: 1.383g/cm³ (Cal.)
• Boiling point: 367.603°C at 760 mmHg (Cal.)
• Flash point: 176.12°C (Cal.)
• Refractive index: 1.523 (Cal.)