Cas no 893638-28-3 ([1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-3',5'-bis(trifluoromethyl)-)

[1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-3',5'-bis(trifluoromethyl)- structure
893638-28-3 structure
Product Name:[1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-3',5'-bis(trifluoromethyl)-
CAS No:893638-28-3
MF:C15H8F6O3
MW:350.212645530701
CID:720373
PubChem ID:23005116
Update Time:2025-04-19

[1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-3',5'-bis(trifluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-3-carboxylicacid, 4-hydroxy-3',5'-bis(trifluoromethyl)-
    • 5-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxybenzoic acid
    • [1,1'-Biphenyl]-3-carboxylic acid,4-hydroxy-3',5'-bis(trifluoromethyl)
    • 4-Hydroxy-3',5'-bis(trifluoromethyl)-[1,1'-biphenyl]-3-carboxylicacid
    • 4-Hydroxy-3',5'-bis(trifluoromethyl)biphenyl-3-carboxylic acid
    • 893638-28-3
    • 4-Hydroxy-3',5'-bis(trifluoromethyl)[1,1'-biphenyl]-3-carboxylic acid
    • 4-Hydroxy-3',5'-bis(trifluoromethyl)-[1,1'-biphenyl]-3-carboxylic acid
    • SCHEMBL3992190
    • [1,1'-Biphenyl]-3-carboxylic acid, 4-hydroxy-3',5'-bis(trifluoromethyl)-
    • AKOS004117224
    • DTXSID30629607
    • CAQBXYCSAHRHOR-UHFFFAOYSA-N
    • Inchi: 1S/C15H8F6O3/c16-14(17,18)9-3-8(4-10(6-9)15(19,20)21)7-1-2-12(22)11(5-7)13(23)24/h1-6,22H,(H,23,24)
    • InChI Key: CAQBXYCSAHRHOR-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C(F)(F)F)C=C(C=1)C1C=CC(=C(C(=O)O)C=1)O)(F)F

Computed Properties

  • Exact Mass: 350.03800
  • Monoisotopic Mass: 350.03776309g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 4
  • Complexity: 439
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.8
  • Topological Polar Surface Area: 57.5?2

Experimental Properties

  • PSA: 57.53000
  • LogP: 4.79500
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