Cas no 1067-73-8 (Diethyl (2-oxobutyl)phosphonate)

Diethyl (2-oxobutyl)phosphonate structure
1067-73-8 structure
Product Name:Diethyl (2-oxobutyl)phosphonate
CAS No:1067-73-8
MF:C8H17O4P
MW:208.191943883896
CID:893832
PubChem ID:24879913
Update Time:2025-09-28

Diethyl (2-oxobutyl)phosphonate Chemical and Physical Properties

Names and Identifiers

    • Diethyl (2-oxobutyl)phosphonate
    • 1-diethoxyphosphorylbutan-2-one
    • DIETHYL (2-OXOBUTYL)PHOSPHONATE 96
    • (2-oxo-butyl)-phosphonic acid diethyl ester
    • (2-Oxo-butyl)-phosphonsaeure-diaethylester
    • (2-oxo-butyl)-phosphoric acid diethyl ester
    • 1-(diethylphosphono)butan-2-one
    • 1-diethoxyphosphoryl-butan-2-one
    • diethyl 2-oxobutane-3-phosphonate
    • Diethyl propanoylmethylphosphonate
    • (2-Oxobutyl)phosphonic acid diethyl ester
    • DIETHYL (2-OXOBUTYL)PHOSPHONATE 96
    • AKOS015916080
    • Diethyl(2-oxobutyl)phosphonate 96
    • J-001646
    • 1067-73-8
    • diethyl 2-oxobutylphosphonate
    • Phosphonic acid, (2-oxobutyl)-, diethyl ester
    • BP-12944
    • diethyl(2-oxobutyl)phosphonate
    • DTXSID50405349
    • SCHEMBL712616
    • CS-0204430
    • BAA06773
    • Diethyl (2-oxobutyl)phosphonate, 96%
    • MDL: MFCD03427248
    • Inchi: 1S/C8H17O4P/c1-4-8(9)7-13(10,11-5-2)12-6-3/h4-7H2,1-3H3
    • InChI Key: GQBVFZDYDHGZPY-UHFFFAOYSA-N
    • SMILES: P(CC(CC)=O)(=O)(OCC)OCC

Computed Properties

  • Exact Mass: 208.08600
  • Monoisotopic Mass: 208.08644602g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 7
  • Complexity: 192
  • 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
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 0.4
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.072?g/mL?at 25?°C(lit.)
  • Flash Point: Degrees Fahrenheit:>230°F
    Degrees Celsius:>110°C
  • Refractive Index: n20/D 1.4360(lit.)
  • PSA: 62.41000
  • LogP: 2.23160
  • Solubility: Not determined

Diethyl (2-oxobutyl)phosphonate Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

Diethyl (2-oxobutyl)phosphonate Customs Data

  • HS CODE:2931900090
  • Customs Data:

    China Customs Code:

    2931900090

    Overview:

    2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%

    Summary:

    2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

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