Cas no 1352999-94-0 (3-Fluoro-5-(trifluoromethoxy)phenylacetic acid)

3-Fluoro-5-(trifluoromethoxy)phenylacetic acid structure
1352999-94-0 structure
Product Name:3-Fluoro-5-(trifluoromethoxy)phenylacetic acid
CAS No:1352999-94-0
MF:C9H6F4O3
MW:238.135756969452
CID:3161330
PubChem ID:66523550
Update Time:2025-04-21

3-Fluoro-5-(trifluoromethoxy)phenylacetic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Fluoro-5-(trifluoromethoxy)phenylacetic acid
    • 3-Fluoro-5-(trifluoroMethoxy)phenylacetic acid, 97%
    • Benzeneacetic acid, 3-fluoro-5-(trifluoromethoxy)-
    • 2-[3-fluoro-5-(trifluoromethoxy)phenyl]acetic acid
    • 2-(3-Fluoro-5-(trifluoromethoxy)phenyl)aceticacid
    • JS-4934
    • SCHEMBL25460728
    • AKOS015957146
    • 2-(3-Fluoro-5-(trifluoromethoxy)phenyl)acetic acid
    • 1352999-94-0
    • D96290
    • CEC99994
    • MDL: MFCD18783228
    • Inchi: 1S/C9H6F4O3/c10-6-1-5(3-8(14)15)2-7(4-6)16-9(11,12)13/h1-2,4H,3H2,(H,14,15)
    • InChI Key: LEUVGYUDBIAFFK-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=C(C=1)CC(=O)O)OC(F)(F)F

Computed Properties

  • Exact Mass: 238.02530670g/mol
  • Monoisotopic Mass: 238.02530670g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 254
  • 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: 2.7
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.5±0.1 g/cm3
  • Melting Point: Not available
  • Boiling Point: 245.0±35.0 °C at 760 mmHg
  • Flash Point: 101.9±25.9 °C
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

3-Fluoro-5-(trifluoromethoxy)phenylacetic acid Pricemore >>

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