Cas no 210491-38-6 (4-Bromo-2,6-bis(trifluoromethyl)benzoic acid)

4-Bromo-2,6-bis(trifluoromethyl)benzoic acid structure
210491-38-6 structure
Product Name:4-Bromo-2,6-bis(trifluoromethyl)benzoic acid
CAS No:210491-38-6
MF:C9H3BrF6O2
MW:337.013343095779
MDL:MFCD13181613
CID:1083466
PubChem ID:15370695
Update Time:2025-07-31

4-Bromo-2,6-bis(trifluoromethyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2,6-bis(trifluoromethyl)benzoic acid
    • 2,6-Bis(trifluoromethyl)-4-bromo-benzoic acid
    • SCHEMBL4171508
    • 210491-38-6
    • AKOS022181560
    • 4-Bromo-2,6-bis(trifluoromethyl)benzoicacid
    • Benzoic acid, 4-bromo-2,6-bis(trifluoromethyl)-
    • AB93069
    • CS-0195393
    • E90824
    • MFCD13181613
    • DB-367405
    • MDL: MFCD13181613
    • Inchi: 1S/C9H3BrF6O2/c10-3-1-4(8(11,12)13)6(7(17)18)5(2-3)9(14,15)16/h1-2H,(H,17,18)
    • InChI Key: ISXFFWSLEJLRHB-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(F)(F)F)C(C(=O)O)=C(C(F)(F)F)C=1

Computed Properties

  • Exact Mass: 335.92206g/mol
  • Monoisotopic Mass: 335.92206g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 302
  • 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: 3.9
  • Topological Polar Surface Area: 37.3?2

4-Bromo-2,6-bis(trifluoromethyl)benzoic acid Pricemore >>

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