4-Trifluoromethyl-2,3,5,6-tetrafluorothiophenol

• CAS: 651-84-3
• Catalog Number: ACM651843
• Category: Other Products
• Molecular Weight: 250.14g/mol
• Molecular Formula: C7HF7S
• IUPAC Name: 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzenethiol
• Canonical SMILES: C1(=C(C(=C(C(=C1F)F)S)F)F)C(F)(F)F
• InChI: InChI=1S/C7HF7S/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H
• InChI Key: BXMOMKVOHOSVJH-UHFFFAOYSA-N
• Complexity: 214
• Covalently-Bonded Unit Count: 1
• Exact Mass: 249.968718g/mol
• Formal Charge: 0
• H-Bond Acceptor: 8
• H-Bond Donor: 1
• Heavy Atom Count: 15
• Monoisotopic Mass: 249.968718g/mol
• Rotatable Bond Count: 0
• XLogP3: 3.4