Methyl (diethylphosphono)acetate

C₇H₁₅O₅PCAS 1067-74-9210.17 g/mol

Open in Covalent MOL file

Ester Phosphate

Properties

Molecular formula: C₇H₁₅O₅P
Molar mass: 210.17 g/mol
Exact mass: 210.0657 Da
Density: 1.1611 g/mL (at 20 °C)
Boiling point: 99 °C (at 1 Torr)
logP: 1.43Crippen estimate
Polar surface area: 61.8 Å²
H-bond donors / acceptors: 0 / 5
Rotatable bonds: 6

Identifiers

CAS number

1067-74-9

SMILES

CCOP(=O)(CC(=O)OC)OCC

InChIKey

CTSAXXHOGZNKJR-UHFFFAOYSA-N

InChI

InChI=1S/C7H15O5P/c1-4-11-13(9,12-5-2)6-7(8)10-3/h4-6H2,1-3H3

Weigh it out

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

Names and synonyms

23 names · show all

(Methoxycarbonylmethyl) diethoxyphosphine oxide
Acetic acid, 2-(diethoxyphosphinyl)-, methyl ester
Acetic acid, phosphono-, P,P-diethyl methyl ester
Acetic acid, (diethoxyphosphinyl)-, methyl ester
Acetic acid, phosphono-, diethyl 1-methyl ester
Diethylphosphonoacetic acid methyl ester
Diethyl methoxycarbonylmethanephosphonate
Diethyl carbomethoxymethylphosphonate
Diethyl phosphonate, methoxycarbonylmethyl-
O,O-Diethyl phosphonoacetic acid methyl ester
Methoxycarbonylmethanephosphonic acid diethyl ester
Methyl diethoxyphosphonoacetate
Methyl di-O-ethylphosphonoacetate
Diethyl (methoxycarbonylmethyl)phosphonate
[(Methoxycarbonyl)methyl]phosphonic acid diethyl ester
Methyl 2-(diethylphosphonato)acetate
(Diethoxyphosphinyl)acetic acid methyl ester
Methyl (diethoxyphosphinyl)acetate
NSC 147757
Methyl 2-(diethylphosphono)acetate
Methyl 2-(diethoxyphosphono)acetate
Methyl 2-(diethoxyphosphinyl)acetate
Methyl 2-(diethoxyphosphoryl)acetate

Work with Methyl (diethylphosphono)acetate

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

Diethyl (ethoxycarbonyl)phosphonate1474-78-8

Elsewhere

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