Cas no 52134-36-8 (Benzoic acid, 4-[(hydroxyamino)carbonyl]-, methyl ester)

Benzoic acid, 4-[(hydroxyamino)carbonyl]-, methyl ester structure
52134-36-8 structure
Product Name:Benzoic acid, 4-[(hydroxyamino)carbonyl]-, methyl ester
CAS No:52134-36-8
MF:C9H9NO4
MW:195.172062635422
CID:336188
PubChem ID:16081868
Update Time:2025-04-19

Benzoic acid, 4-[(hydroxyamino)carbonyl]-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 4-[(hydroxyamino)carbonyl]-, methyl ester
    • methyl 4-(hydroxycarbamoyl)benzoate
    • SCHEMBL4394811
    • DTXSID40582057
    • A903172
    • 52134-36-8
    • Inchi: 1S/C9H9NO4/c1-14-9(12)7-4-2-6(3-5-7)8(11)10-13/h2-5,13H,1H3,(H,10,11)
    • InChI Key: VEJFPBLBWXRFFU-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=CC(C(NO)=O)=CC=1)=O

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: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 221
  • 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: 1
  • Topological Polar Surface Area: 75.6?2
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