Cas no 16309-18-5 (Benzoic acid,2-hydroxy-, decyl ester)

Benzoic acid,2-hydroxy-, decyl ester structure
16309-18-5 structure
Product Name:Benzoic acid,2-hydroxy-, decyl ester
CAS No:16309-18-5
MF:C17H26O3
MW:278.386545658112
CID:217523
PubChem ID:251252
Update Time:2025-04-19

Benzoic acid,2-hydroxy-, decyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2-hydroxy-, decyl ester
    • decyl 2-hydroxybenzoate
    • AC1L5JFJ
    • AC1Q67A9
    • AR-1I3577
    • CTK4D1425
    • Decylsalicylat
    • n-decyl salicylate
    • n-Decyl-salicylat
    • NSC71528
    • Salicyclsaeure-decylester
    • salicylic acid decyl ester
    • Salicylsaeure-decylester
    • SureCN2798676
    • decyl salicylate
    • DTXSID80290861
    • Benzoic acid, 2-hydroxy-, decyl ester
    • F0HY0Y2NFW
    • decane salicylate
    • NSC-71528
    • 16309-18-5
    • UNII-F0HY0Y2NFW
    • SCHEMBL2798676
    • Inchi: 1S/C17H26O3/c1-2-3-4-5-6-7-8-11-14-20-17(19)15-12-9-10-13-16(15)18/h9-10,12-13,18H,2-8,11,14H2,1H3
    • InChI Key: DEFZNQKDYOBMGU-UHFFFAOYSA-N
    • SMILES: O(C(C1C=CC=CC=1O)=O)CCCCCCCCCC

Computed Properties

  • Exact Mass: 278.18828
  • Monoisotopic Mass: 278.18819469g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 11
  • Complexity: 253
  • 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: 7.9
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53
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