Cas no 875664-49-6 (Benzoic acid,5-ethoxy-2,3-difluoro-)

Benzoic acid,5-ethoxy-2,3-difluoro- structure
875664-49-6 structure
Product Name:Benzoic acid,5-ethoxy-2,3-difluoro-
CAS No:875664-49-6
MF:C9H8F2O3
MW:202.154829978943
CID:709831
PubChem ID:2769400
Update Time:2025-04-19

Benzoic acid,5-ethoxy-2,3-difluoro- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,5-ethoxy-2,3-difluoro-
    • 2,3-DIFLUORO-4-ETHOXYBENZOIC ACID
    • 2,3,9,10-TETRAMETHYLANTRACENE
    • CS-0191517
    • 4-ethoxy-2,3-difluorobenzoicacid
    • EN300-7390147
    • Benzoic acid, 4-ethoxy-2,3-difluoro- (9CI)
    • SCHEMBL704976
    • DTXSID10377710
    • 875664-49-6
    • 124728-45-6
    • Benzoic acid, 4-ethoxy-2,3-difluoro-
    • 2,3-DIFLUORO-4-ETHOXYBENZOICACID
    • 4-Ethoxy-2,3-difluoro benzoic acid
    • 4-ethoxy-2,3-difluorobenzoic acid
    • AKOS015891219
    • KMFHBAZUQFJVKK-UHFFFAOYSA-N
    • 2,3-difluoro-4-ethoxybenzoic acid, AldrichCPR
    • AMY8776
    • FT-0768041
    • MFCD02258849
    • JS-4699
    • Inchi: 1S/C9H8F2O3/c1-2-14-6-4-3-5(9(12)13)7(10)8(6)11/h3-4H,2H2,1H3,(H,12,13)
    • InChI Key: KMFHBAZUQFJVKK-UHFFFAOYSA-N
    • SMILES: FC1C(=C(C(=O)O)C=CC=1OCC)F

Computed Properties

  • Exact Mass: 202.04400
  • Monoisotopic Mass: 202.04415044g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 210
  • 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
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53000
  • LogP: 2.06170

Benzoic acid,5-ethoxy-2,3-difluoro- Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi
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