Cas no 99450-52-9 (2-(acetyloxy)-5-aminobenzoic acid)

2-(acetyloxy)-5-aminobenzoic acid structure
99450-52-9 structure
Product Name:2-(acetyloxy)-5-aminobenzoic acid
CAS No:99450-52-9
MF:C9H9NO4
MW:195.172062635422
MDL:MFCD20640388
CID:750223
PubChem ID:13140652
Update Time:2025-04-19

2-(acetyloxy)-5-aminobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-(acetyloxy)-5-amino-
    • 2-acetyloxy-5-aminobenzoic acid
    • 2-(acetyloxy)-5-aminobenzoic acid
    • PNKIVCMRLDCYJE-UHFFFAOYSA-N
    • SCHEMBL138320
    • acetyl-5-aminosalicylic acid
    • 2-ethanoyloxy-5-aminobenzoic acid
    • 99450-52-9
    • DTXSID20521242
    • MDL: MFCD20640388
    • Inchi: 1S/C9H9NO4/c1-5(11)14-8-3-2-6(10)4-7(8)9(12)13/h2-4H,10H2,1H3,(H,12,13)
    • InChI Key: PNKIVCMRLDCYJE-UHFFFAOYSA-N
    • SMILES: O(C(C)=O)C1C=CC(=CC=1C(=O)O)N

Computed Properties

  • Exact Mass: 195.05315777g/mol
  • Monoisotopic Mass: 195.05315777g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 241
  • 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: 0.5
  • Topological Polar Surface Area: 89.6?2

2-(acetyloxy)-5-aminobenzoic acid Pricemore >>

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