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3095-95-2

3095-95-2 Structure

3095-95-2 Structure
IdentificationBack Directory
[Name]

DIETHYLPHOSPHONOACETIC ACID
[CAS]

3095-95-2
[Synonyms]

NSC 272281
acetyl diethyl phosphate
(diethoxyphosphoryl)acetate
DIETHYLPHOSPHONOACETIC ACID
DIETHYLPHOSPHONOETHANOIC ACID
Diethoxyphosphorylacetic acid
DIETHYLCARBOXYMETHYLPHOSPHONATE
(Diethoxyphosphinyl)acetic acid
Diethylphosphonoacetic acid,98%
Diethylphosphonoacetic acid 95%
(DIETHOXYPHOSPHINOYL)ACETIC ACID
2-(Diethoxyphosphinyl)acetic acid
Diethyl carboxymethanephosphonate
2-(diethoxyphosphoryl)acetic acid
Acetic acid,2-(diethoxyphosphinyl)-
Diethylphosphonoacetic acid, 98% 25GR
Diethylcarboxymethylphosphonate, 98 %
Phosphono-acetic acid P,P-diethyl ester
Diethyl (hydroxycarbonylmethyl)phosphonate
(Diethoxyphosphoryl)acetic acid, Diethylphosphonoacetic acid
[EINECS(EC#)]

608-560-3
[Molecular Formula]

C6H13O5P
[MDL Number]

MFCD00192032
[MOL File]

3095-95-2.mol
[Molecular Weight]

196.14
Chemical PropertiesBack Directory
[Appearance]

clear colorless to yellow viscous liquid
[Boiling point ]

150 °C0.05 mm Hg(lit.)
[density ]

1.220 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.445(lit.)
[Fp ]

>230 °F
[storage temp. ]

Store at 0-5°C
[form ]

Viscous Liquid
[pka]

3.48±0.10(Predicted)
[color ]

Clear colorless to yellow
[Specific Gravity]

1.220
[InChI]

InChI=1S/C6H13O5P/c1-3-10-12(9,11-4-2)5-6(7)8/h3-5H2,1-2H3,(H,7,8)
[InChIKey]

DVQMPWOLBFKUMM-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CP(OCC)(OCC)=O
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to yellow viscous liquid
[Uses]

Diethylphosphonoacetic Acid is a reagent that is used for enantioselective preparation of α-phosphoryl-α,β-unsatd.-δ-aryl-δ-lactones from nonracemic β-hydroxyaldehydes and their conversion to α-methylene-δ-aryl-δ-lactones.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 102, p. 4534, 1980 DOI: 10.1021/ja00533a047
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

37/39-26
[WGK Germany ]

3
[HS Code ]

29319090
Spectrum DetailBack Directory
[Spectrum Detail]

DIETHYLPHOSPHONOACETIC ACID(3095-95-2)1HNMR
DIETHYLPHOSPHONOACETIC ACID(3095-95-2)31PNMR
DIETHYLPHOSPHONOACETIC ACID(3095-95-2)Raman
DIETHYLPHOSPHONOACETIC ACID(3095-95-2)IR
DIETHYLPHOSPHONOACETIC ACID(3095-95-2)FT-IR
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