Cas no 5434-76-4 (Benzoic acid,4-hydroxy-, phenylmethyl ester, zinc salt (2:1))

Benzoic acid,4-hydroxy-, phenylmethyl ester, zinc salt (2:1) structure
5434-76-4 structure
Product Name:Benzoic acid,4-hydroxy-, phenylmethyl ester, zinc salt (2:1)
CAS No:5434-76-4
MF:C14H12O3Zn
MW:293.652280807495
CID:383506
PubChem ID:138399957
Update Time:2025-04-19

Benzoic acid,4-hydroxy-, phenylmethyl ester, zinc salt (2:1) Chemical and Physical Properties

Names and Identifiers

    • Benzoicacid, 4-hydroxy-, phenylmethyl ester, zinc salt (9CI)
    • Benzoic acid,4-hydroxy-, phenylmethyl ester, zinc salt (2:1)
    • zinc,benzyl 4-hydroxybenzoate
    • DTXSID00969426
    • Benzyl 4-hydroxybenzoate--zinc (1/1)
    • 5434-76-4
    • Inchi: 1S/C14H12O3.Zn/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11;/h1-9,15H,10H2;
    • InChI Key: KDYMFCQKEWNLOS-UHFFFAOYSA-N
    • SMILES: [Zn].O(C(C1C=CC(=CC=1)O)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 292.008
  • Monoisotopic Mass: 292.008
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 238
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 46.5A^2
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