Cas no 6938-39-2 (Benzoic acid,4-methoxy-, propyl ester)

Benzoic acid,4-methoxy-, propyl ester structure
6938-39-2 structure
Product Name:Benzoic acid,4-methoxy-, propyl ester
CAS No:6938-39-2
MF:C11H14O3
MW:194.227063655853
CID:518186
PubChem ID:243787
Update Time:2025-04-19

Benzoic acid,4-methoxy-, propyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-methoxy-, propyl ester
    • propyl 4-methoxybenzoate
    • 4-Methoxy Benzoic Acid Propyl Ester
    • Methyl ether of Propylparaben
    • p-Anisic acid, propyl ester
    • Propyl p-methoxybenzoate
    • AKOS008947942
    • DTXSID10288054
    • NSC-53955
    • 6938-39-2
    • Propyl 4-methoxybenzoate #
    • SCHEMBL1988247
    • Benzoic acid, 4-methoxy-, propyl ester
    • NSC53955
    • n-propyl anisate
    • NSC 53955
    • Inchi: 1S/C11H14O3/c1-3-8-14-11(12)9-4-6-10(13-2)7-5-9/h4-7H,3,8H2,1-2H3
    • InChI Key: WEHMFTWWOGBHCR-UHFFFAOYSA-N
    • SMILES: O(C(C1C=CC(=CC=1)OC)=O)CCC

Computed Properties

  • Exact Mass: 194.09432
  • Monoisotopic Mass: 194.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 171
  • 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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