chempirical

Diethyl decylphosphonate

C14H31O3PCAS 16165-68-7278.37 g/mol

Open in Covalent MOL file
POOO
Phosphonate

Properties

Molecular formula
C14H31O3P
Molar mass
278.37 g/mol
Exact mass
278.2011 Da
logP
5.39Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
13

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
16165-68-7
SMILES
CCCCCCCCCCP(=O)(OCC)OCC
InChIKey
HYQXIVAZQBYBAF-UHFFFAOYSA-N
InChI
InChI=1S/C14H31O3P/c1-4-7-8-9-10-11-12-13-14-18(15,16-5-2)17-6-3/h4-14H2,1-3H3

Weigh it out

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

Names and synonyms

1 names
  • Diethyl 1-decylphosphonate

Work with Diethyl decylphosphonate

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 butylphosphonate2404-75-384 % similar Diethyl propylphosphonate18812-51-672 % similar Tetraethyl ethylenediphosphonate995-32-464 % similar Diethyl P-(2-bromoethyl)phosphonate5324-30-153 % similar Tetraethyl methylenediphosphonate1660-94-252 % similar Triethyl 4-phosphonobutyrate2327-69-751 % similar Diethyl P-[2-(triethoxysilyl)ethyl]phosphonate757-44-850 % similar Diethyl ethylphosphonate78-38-650 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tetradecylphosphonic acid4671-75-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook