Diethyl (ethoxyacetyl)phosphonate

C₈H₁₇O₅PCAS 30492-56-9224.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₇O₅P
Molar mass: 224.19 g/mol
Exact mass: 224.0814 Da
logP: 1.82Crippen estimate
Polar surface area: 61.8 Å²
H-bond donors / acceptors: 0 / 5
Rotatable bonds: 8

Identifiers

CAS number

30492-56-9

SMILES

CCOCC(=O)P(=O)(OCC)OCC

InChIKey

CNRJHNUKTBRUGP-UHFFFAOYSA-N

InChI

InChI=1S/C8H17O5P/c1-4-11-7-8(9)14(10,12-5-2)13-6-3/h4-7H2,1-3H3

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Names and synonyms

2 names

Phosphonic acid, (ethoxyacetyl)-, diethyl ester
1-Diethoxyphosphoryl-2-ethoxyethanone

Work with Diethyl (ethoxyacetyl)phosphonate

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

Same formula

Triethyl phosphonoacetate867-13-0

Elsewhere

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