Cas no 10276-87-6 (Phosphoric acid,(3,4-dimethylphenyl)methyl diethyl ester)

Phosphoric acid,(3,4-dimethylphenyl)methyl diethyl ester structure
10276-87-6 structure
Product Name:Phosphoric acid,(3,4-dimethylphenyl)methyl diethyl ester
CAS No:10276-87-6
MF:C13H21O4P
MW:272.277205228806
CID:234404
PubChem ID:229788
Update Time:2025-04-19

Phosphoric acid,(3,4-dimethylphenyl)methyl diethyl ester Chemical and Physical Properties

Names and Identifiers

    • Phosphoric acid,(3,4-dimethylphenyl)methyl diethyl ester
    • (3,4-dimethylphenyl)methyl diethyl phosphate
    • 3,4-dimethylbenzyl diethyl phosphate
    • AC1L5I2Y
    • AC1Q6SVR
    • AG-J-43329
    • AR-1E9282
    • CTK4A1461
    • Diaethyl-(3,4-dimethyl-benzyl)-phosphat
    • Diaethyl-< 3,4-dimethyl-benzyl> -phosphat
    • NSC23745
    • 10276-87-6
    • NSC-23745
    • DTXSID90281987
    • Inchi: 1S/C13H21O4P/c1-5-15-18(14,16-6-2)17-10-13-8-7-11(3)12(4)9-13/h7-9H,5-6,10H2,1-4H3
    • InChI Key: XOVCIWPCZPLXPV-UHFFFAOYSA-N
    • SMILES: P(=O)(OCC)(OCC)OCC1C=CC(C)=C(C)C=1

Computed Properties

  • Exact Mass: 272.11783
  • Monoisotopic Mass: 272.11774614g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 7
  • Complexity: 272
  • 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: 2.5
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • PSA: 44.76
  • LogP: 4.00110
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