2-[(3-Fluorophenyl)Thio]-5-(Trifluoromethyl)Benzoic Acid
[CAS# 53542-36-2]

Identification

• Name: 2-[(3-Fluorophenyl)Thio]-5-(Trifluoromethyl)Benzoic Acid
• Synonyms: 2-[(3-Fluorophenyl)Thio]-5-(Trifluoromethyl)Benzoic Acid; 2-((3-Fluorophenyl)Thio)-5-(Trifluoromethyl)Benzoic Acid
• Molecular Formula: C₁₄H₈F₄O₂S
• Molecular Weight: 316.27
• CAS Registry Number: 53542-36-2
• EINECS: 258-617-8
• SMILES: C1=C(C=CC=C1F)SC2=C(C=C(C(F)(F)F)C=C2)C(=O)O
• InChI: 1S/C14H8F4O2S/c15-9-2-1-3-10(7-9)21-12-5-4-8(14(16,17)18)6-11(12)13(19)20/h1-7H,(H,19,20)
• InChIKey: JADNZDIOGGBXLP-UHFFFAOYSA-N

Properties

• Density: 1.498g/cm³ (Cal.)
• Boiling point: 394.48°C at 760 mmHg (Cal.)
• Flash point: 192.375°C (Cal.)