Ethyl (5Z)-4-[4-Chloro-2-(Trifluoromethyl)Phenyl]-5-(Cyanoimino)-4,5-Dihydro-1,3,4-Thiadiazole-2-Carboxylate
[CAS# 148367-88-8]

Identification

• Name: Ethyl (5Z)-4-[4-Chloro-2-(Trifluoromethyl)Phenyl]-5-(Cyanoimino)-4,5-Dihydro-1,3,4-Thiadiazole-2-Carboxylate
• Synonyms: Ethyl 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cya; Ethyl 4-[4-chloro-2-(trifluoromethyl)phenyl]-5-cyanamide-4,5-dihydro-1,3,4-thiadiazole-2-carboxylate; namide-4,5-dihydro-1,3,4-thiadiazole-2-carboxylate
• Molecular Formula: C₁₃H₈ClF₃N₄O₂S
• Molecular Weight: 376.74
• CAS Registry Number: 148367-88-8
• SMILES: N#C\N=C2/S\C(=N/N2c1ccc(Cl)cc1C(F)(F)F)C(=O)OCC
• InChI: 1S/C13H8ClF3N4O2S/c1-2-23-11(22)10-20-21(12(24-10)19-6-18)9-4-3-7(14)5-8(9)13(15,16)17/h3-5H,2H2,1H3/b19-12-
• InChIKey: LGNMKXKAVBIYBA-UNOMPAQXSA-N

Properties

• Density: 1.553g/cm³ (Cal.)
• Boiling point: 421.888°C at 760 mmHg (Cal.)
• Flash point: 208.951°C (Cal.)
• Refractive index: 1.608 (Cal.)