4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture

Modify Date: 2025-08-25 12:13:12

4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture Structure
4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture structure
 Common Name 4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture
CAS Number 87549-50-6 Molecular Weight 217.20200
Density N/A Boiling Point N/A
Molecular Formula C9H16NO3P Melting Point N/A
MSDS USA Flash Point N/A

 Names

Name Diethyl [(2E)-3-cyano-2-methyl-2-propen-1-yl]phosphonate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C9H16NO3P
Molecular Weight 217.20200
Exact Mass 217.08700
PSA 69.13000
LogP 2.72238
InChIKey OPUURRZDCJCVGT-UHFFFAOYSA-N
SMILES CCOP(=O)(CC(C)=CC#N)OCC

 Safety Information

Personal Protective Equipment Eyeshields;Gloves
RIDADR NONH for all modes of transport

 Synthetic Route

4-chloro-3-methylbut-2-enenitrile structure

4-chloro-3-meth...

CAS#:4450-34-4

Triethyl phosphite structure

Triethyl phosphite

CAS#:122-52-1

~66%

4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture Structure

4-(Diethylphosp...

CAS#:87549-50-6

Literature: Sovdat, Tina; Bassolino, Giovanni; Liebel, Matz; Schnedermann, Christoph; Fletcher, Stephen P.; Kukura, Philipp Journal of the American Chemical Society, 2012 , vol. 134, # 20 p. 8318 - 8320

 Synonyms

Diethyl 3-methyl-4-phosphonocrotononitrile
diethyl o-methoxybenzylidenemalonate
diethyl 3-cyano-2-methylprop-2-enyl-phosphonate
2-Methoxy-benzalmalonsaeure-diaethylester
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Chemsrc provides CAS#:87549-50-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture>> amp version: 4-(Diethylphosphono)-3-methyl-2-butenenitrile, E/Z mixture

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