Cas no 867-17-4 (Phosphoric acid,diethyl methyl ester)

Phosphoric acid,diethyl methyl ester structure
867-17-4 structure
Product Name:Phosphoric acid,diethyl methyl ester
CAS No:867-17-4
MF:C5H13O4P
MW:168.128082990646
CID:724529
PubChem ID:120420
Update Time:2025-04-19

Phosphoric acid,diethyl methyl ester Chemical and Physical Properties

Names and Identifiers

    • Phosphoric acid,diethyl methyl ester
    • DIETHYLMETHYLPHOSPHATE
    • Ethyl methyl phosphate ((EtO)2(MeO)PO)
    • Phosphate diethylmethyl [French]
    • SCHEMBL575185
    • UNII-R7HE04G57P
    • 0-01-00-00332 (Beilstein Handbook Reference)
    • Q27287897
    • BRN 1704568
    • 1466 H.C.
    • Diethyl methyl phosphate
    • DTXSID101007032
    • R7HE04G57P
    • AKOS006277924
    • Phosphate diethylmethyl
    • UAEWCWCMYQAIDR-UHFFFAOYSA-N
    • 867-17-4
    • Phosphoric acid, diethyl methyl ester
    • Inchi: 1S/C5H13O4P/c1-4-8-10(6,7-3)9-5-2/h4-5H2,1-3H3
    • InChI Key: UAEWCWCMYQAIDR-UHFFFAOYSA-N
    • SMILES: P(=O)(OC)(OCC)OCC

Computed Properties

  • Exact Mass: 168.05500
  • Monoisotopic Mass: 168.05514589g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 115
  • 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: 0.3
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • PSA: 54.57000
  • LogP: 1.81390

Phosphoric acid,diethyl methyl ester Production Method

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