Cas no 25774-60-1 (Acetic acid, phenoxy-, phenyl ester)

Acetic acid, phenoxy-, phenyl ester structure
25774-60-1 structure
Product Name:Acetic acid, phenoxy-, phenyl ester
CAS No:25774-60-1
MF:C14H12O3
MW:228.243284225464
CID:1424136
PubChem ID:873996
Update Time:2025-04-20

Acetic acid, phenoxy-, phenyl ester Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, phenoxy-, phenyl ester
    • phenyl 2-phenoxyacetate
    • AI-020/12772001
    • 25774-60-1
    • DTXSID20357987
    • AKOS002954399
    • HMS1585P09
    • SCHEMBL472034
    • phenyl phenoxyacetate
    • AB00098257-01
    • Inchi: 1S/C14H12O3/c15-14(17-13-9-5-2-6-10-13)11-16-12-7-3-1-4-8-12/h1-10H,11H2
    • InChI Key: PJANUNZPZUHMPM-UHFFFAOYSA-N
    • SMILES: O(CC(=O)OC1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 228.07866
  • Monoisotopic Mass: 228.078644241g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 228
  • 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: 3.4
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53
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