Cas no 874838-32-1 (5-Amino-2,3-difluorobenzoic acid)

5-Amino-2,3-difluorobenzoic acid structure
874838-32-1 structure
Product Name:5-Amino-2,3-difluorobenzoic acid
CAS No:874838-32-1
MF:C7H5F2NO2
MW:173.116908788681
MDL:MFCD04972478
CID:1089913
PubChem ID:40427037
Update Time:2025-09-23

5-Amino-2,3-difluorobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 5-Amino-2,3-difluorobenzoic acid
    • YQXQZKKJAITNKW-UHFFFAOYSA-N
    • AB21104
    • AK141762
    • SCHEMBL671650
    • AS-60887
    • CS-0111954
    • ZJB83832
    • AKOS012323299
    • D70727
    • MFCD04972478
    • DTXSID80654227
    • 874838-32-1
    • FT-0707197
    • EN300-147809
    • 5-Amino-2,3-difluorobenzoicacid
    • DB-332836
    • MDL： MFCD04972478
    • Inchi： 1S/C7H5F2NO2/c8-5-2-3(10)1-4(6(5)9)7(11)12/h1-2H,10H2,(H,11,12)
    • InChI Key： YQXQZKKJAITNKW-UHFFFAOYSA-N
    • SMILES： FC1=C(C=C(C=C1C(=O)O)N)F

Computed Properties

  • Exact Mass: 173.02883473g/mol
  • Monoisotopic Mass: 173.02883473g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 188
  • 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
  • Topological Polar Surface Area: 63.3
  • XLogP3: 1

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