Cas no 88584-98-9 (Phosphonic acid, [3-(acetyloxy)propyl]-, dibutyl ester)

Phosphonic acid, [3-(acetyloxy)propyl]-, dibutyl ester structure
88584-98-9 structure
Product Name:Phosphonic acid, [3-(acetyloxy)propyl]-, dibutyl ester
CAS No:88584-98-9
MF:C13H27O5P
MW:294.324245691299
CID:627715
PubChem ID:13088440
Update Time:2025-04-19

Phosphonic acid, [3-(acetyloxy)propyl]-, dibutyl ester Chemical and Physical Properties

Names and Identifiers

    • Phosphonic acid, [3-(acetyloxy)propyl]-, dibutyl ester
    • 3-dibutoxyphosphorylpropyl acetate
    • 88584-98-9
    • 3-(Dibutoxyphosphoryl)propyl acetate
    • DTXSID80517803
    • Inchi: 1S/C13H27O5P/c1-4-6-10-17-19(15,18-11-7-5-2)12-8-9-16-13(3)14/h4-12H2,1-3H3
    • InChI Key: PGGIXPOXFAFKPW-UHFFFAOYSA-N
    • SMILES: P(CCCOC(C)=O)(=O)(OCCCC)OCCCC

Computed Properties

  • Exact Mass: 294.15961096g/mol
  • Monoisotopic Mass: 294.15961096g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 13
  • Complexity: 266
  • 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: 2.2
  • Topological Polar Surface Area: 61.8?2
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