Ethyl 4-Hydroxy-2-[3-(Trifluoromethyl)Phenyl]-1,3-Thiazole-5-Carboxylate
[CAS# 240800-53-7]

Identification

• Name: Ethyl 4-Hydroxy-2-[3-(Trifluoromethyl)Phenyl]-1,3-Thiazole-5-Carboxylate
• Synonyms: 3-[5-(Ethoxycarbonyl)-4-hydroxy-1,3-thiazol-2-yl]benzotrifluoride; 5-(Ethoxycarbonyl)-4-hydroxy-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole; 5-(Ethoxycarbonyl)-4-hydroxy-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole, 3-[5-(Ethoxycarbonyl)-4-hydroxy-1,3-thiazol-2-yl]benzotrifluoride
• Molecular Formula: C₁₃H₁₀F₃NO₃S
• Molecular Weight: 317.28
• CAS Registry Number: 240800-53-7
• SMILES: CCOC(=O)C1=C(N=C(S1)C2=CC(=CC=C2)C(F)(F)F)O
• InChI: 1S/C13H10F3NO3S/c1-2-20-12(19)9-10(18)17-11(21-9)7-4-3-5-8(6-7)13(14,15)16/h3-6,18H,2H2,1H3
• InChIKey: WRONBITZBMSSSZ-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Melting point: 108-110°C (Expl.)
• Boiling point: 395.3±52.0°C at 760 mmHg (Cal.)
• Flash point: 192.9±30.7°C (Cal.)
• Refractive index: 1.544 (Cal.)

Safety Data

• Safety Description: S3,S15,S22,S24/25,S36/37/39,S45