Cas no 10581-14-3 (Phosphoric acid,monooctyl monophenyl ester)

Phosphoric acid,monooctyl monophenyl ester structure
10581-14-3 structure
Product Name:Phosphoric acid,monooctyl monophenyl ester
CAS No:10581-14-3
MF:C14H23O4P
MW:286.303785562515
CID:162597
PubChem ID:82742
Update Time:2025-04-19

Phosphoric acid,monooctyl monophenyl ester Chemical and Physical Properties

Names and Identifiers

    • Phosphoric acid,monooctyl monophenyl ester
    • Octyl phenyl hydrogen phosphate
    • DTXSID70147355
    • 3CT67YDE5F
    • 10581-14-3
    • NS00053312
    • EINECS 234-180-9
    • monooctylphenylphosphoric acid
    • SCHEMBL1100962
    • Phosphoric acid, monooctyl monophenyl ester
    • Inchi: 1S/C14H23O4P/c1-2-3-4-5-6-10-13-17-19(15,16)18-14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3,(H,15,16)
    • InChI Key: SDWUQIDETLBAIU-UHFFFAOYSA-N
    • SMILES: P(=O)(O)(OC1C=CC=CC=1)OCCCCCCCC

Computed Properties

  • Exact Mass: 286.13349
  • Monoisotopic Mass: 286.13339621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 10
  • Complexity: 264
  • 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: 4.2
  • Topological Polar Surface Area: 55.8?2

Experimental Properties

  • PSA: 55.76
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