4-Mercapto-1,1,1-Trifluoro-4-(2-Thienyl)-3-Buten-2-One
[CAS# 4552-64-1]

Identification

• Name: 4-Mercapto-1,1,1-Trifluoro-4-(2-Thienyl)-3-Buten-2-One
• Synonyms: 1,1,1-Trifluoro-4-Sulfanyl-4-Thiophen-2-Ylbut-3-En-2-One; (Z)-1,1,1-Trifluoro-4-Sulfanyl-4-(2-Thienyl)But-3-En-2-One; 1,1,1-Trifluoro-4-Sulfanyl-4-(2-Thienyl)But-3-En-2-One
• Molecular Formula: C₈H₅F₃OS₂
• Molecular Weight: 238.24
• CAS Registry Number: 4552-64-1
• SMILES: C1=C(/C(=C/C(C(F)(F)F)=O)S)SC=C1
• InChI: 1S/C8H5F3OS2/c9-8(10,11)7(12)4-5(13)6-2-1-3-14-6/h1-4,13H/b5-4-
• InChIKey: MTMSNUZWAOVYRU-PLNGDYQASA-N

Properties

• Density: 1.424g/cm³ (Cal.)
• Boiling point: 250.588°C at 760 mmHg (Cal.)
• Flash point: 105.352°C (Cal.)