Diethyl vinylphosphonate

C6H13O3PCAS 682-30-4164.14 g/mol

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POOO
AlkenePhosphonate

Properties

Molecular formula
C6H13O3P
Molar mass
164.14 g/mol
Exact mass
164.0602 Da
Density
1.0529 g/mL (at 20 °C)
Boiling point
50 °C (at 1 Torr)
logP
2.40Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
5

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number
682-30-4
SMILES
C=CP(=O)(OCC)OCC
InChIKey
DREPONDJUKIQLX-UHFFFAOYSA-N
InChI
InChI=1S/C6H13O3P/c1-4-8-10(7,6-3)9-5-2/h6H,3-5H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

8 names
  • Phosphonic acid, P-ethenyl-, diethyl ester
  • Phosphonic acid, vinyl-, diethyl ester
  • Phosphonic acid, ethenyl-, diethyl ester
  • O,O-Diethyl vinylphosphonate
  • Diethoxyphosphinylethene
  • Vinylphosphonic acid diethyl ester
  • Diethyl ethenylphosphonate
  • 1-[Ethenyl(ethoxy)phosphoryl]oxyethane

Work with Diethyl vinylphosphonate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Diethyl P-2-propen-1-ylphosphonate1067-87-447 % similar Triethyl phosphate78-40-044 % similar Tetraethyl pyrophosphate107-49-341 % similar Tetraethyl methylenediphosphonate1660-94-241 % similar Diethyl methylphosphonate683-08-941 % similar Tetraethyl ethylenediphosphonate995-32-441 % similar Ethyl phosphorodichloridate1498-51-739 % similar Hexaethyl tetraphosphate757-58-439 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook