(5E)-2-Sulfanyl-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5H)-one
[CAS# 99460-76-1]

Identification

• Name: (5E)-2-Sulfanyl-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5H)-one
• Synonyms: (5E)-2-mercapto-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5H)-one; (5E)-2-Mercapto-5-[4-(trifluoromethyl)-benzylidene]-1,3-thiazol-4(5H)-one; 2-Thioxo-5-(4-trifluoromethyl-benzylidene)-thiazolidin-4-one
• Molecular Formula: C₁₁H₆F₃NOS₂
• Molecular Weight: 289.30
• CAS Registry Number: 99460-76-1
• SMILES: C1=CC(=CC=C1/C=C/2\C(=O)N=C(S2)S)C(F)(F)F
• InChI: 1S/C11H6F3NOS2/c12-11(13,14)7-3-1-6(2-4-7)5-8-9(16)15-10(17)18-8/h1-5H,(H,15,16,17)/b8-5+
• InChIKey: ZXSOIGQCMUHMHG-VMPITWQZSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 357.5±52.0°C at 760 mmHg (Cal.)
• Flash point: 170.0±30.7°C (Cal.)

Safety Data

• Safety Description: IRRITANT