Cas no 505082-84-8 (4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid)

4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid structure
505082-84-8 structure
Product Name:4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid
CAS No:505082-84-8
MF:C14H8ClF3O2
MW:300.660333633423
CID:933858
PubChem ID:53426191
Update Time:2025-04-19

4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid
    • 4-[2-chloro-5-(trifluoromethyl)phenyl]benzoic acid
    • 2'-fluoro-6'-trifluoromethyl-biphenyl-4-carboxylic acid
    • 505082-84-8
    • 2'-Chloro-5'-(trifluoromethyl)[1,1'-biphenyl]-4-carboxylic acid
    • DB-262552
    • DTXSID00699110
    • NCGC00374179-01
    • Inchi: 1S/C14H8ClF3O2/c15-12-6-5-10(14(16,17)18)7-11(12)8-1-3-9(4-2-8)13(19)20/h1-7H,(H,19,20)
    • InChI Key: OPTVEOGEPSMNOQ-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C(F)(F)F)C=C1C1C=CC(C(=O)O)=CC=1

Computed Properties

  • Exact Mass: 300.01600
  • Monoisotopic Mass: 300.0164917g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 2
  • Complexity: 351
  • 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: 4.6
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.30000
  • LogP: 4.72400

4-(2-Chloro-5-(trifluoromethyl)phenyl)benzoic acid Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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