ChemicalBook--->CAS DataBase List--->5292-53-5

5292-53-5

5292-53-5 Structure

5292-53-5 Structure
IdentificationMore
[Name]

DIETHYL BENZYLIDENEMALONATE
[CAS]

5292-53-5
[Synonyms]

BENZALMALONIC ACID DIETHYL ESTER
BENZALMALONIC ACID ETHYL ESTER
BENZYLIDENEMALONIC ACID DIETHYL ESTER
DIETHYL BENZALMALONATE
DIETHYL BENZYLIDENEMALONATE
2-Benzylidene-malonic acid diethyl ester
2-Benzylidene-malonicaciddiethylester
b,b-Diethoxycarbonylstyrene
Diethyl (phenylmethylene)malonate
Diethyl 2-benzylidenemalonate
diethyl(phenylmethylene)malonate
Ethyl benzylidenemalonate
Malonic acid, benzylidene-, diethyl ester
Propanedioicacid,(phenylmethylene)-,diethylester
AI3-02423
2-Phenylethene-1,1-dicarboxylic acid diethyl ester
Benzalmalonic acid diethyl
Benzylidenemalonic acid diethyl
Ethyl benzalmalonate
α-(Ethoxycarbonyl)cinnamic acid ethyl ester
[EINECS(EC#)]

226-137-8
[Molecular Formula]

C14H16O4
[MDL Number]

MFCD00009149
[Molecular Weight]

248.27
[MOL File]

5292-53-5.mol
Chemical PropertiesBack Directory
[Melting point ]

28-31°C
[Boiling point ]

215-217 °C/30 mmHg (lit.)
[density ]

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

n20/D 1.536(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

clear liquid
[color ]

Colorless to Yellow
[Water Solubility ]

Insoluble in water.
[BRN ]

528894
[Dielectric constant]

8.0(0℃)
[InChI]

1S/C14H16O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
[InChIKey]

VUWPIBNKJSEYIN-UHFFFAOYSA-N
[SMILES]

CCOC(=O)\C(=C\c1ccccc1)C(=O)OCC
[CAS DataBase Reference]

5292-53-5(CAS DataBase Reference)
Safety DataBack Directory
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[REACH Registrations]

Active
[HS Code ]

29173990
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Uses]

Diethyl benzylidenemalonate is used as a pharmaceutical intermediate. It is also involved in the Conjugate addition of cyanide ion to arylidenemalonic esters provides a useful route to arylsuccinic acids.
[Synthesis Reference(s)]

Organic Syntheses, Coll. Vol. 3, p. 377, 1955
Tetrahedron Letters, 33, p. 7535, 1992 DOI: 10.1016/S0040-4039(00)60817-1
Spectrum DetailBack Directory
[Spectrum Detail]

DIETHYL BENZYLIDENEMALONATE(5292-53-5)MS
DIETHYL BENZYLIDENEMALONATE(5292-53-5)1HNMR
DIETHYL BENZYLIDENEMALONATE(5292-53-5)13CNMR
DIETHYL BENZYLIDENEMALONATE(5292-53-5)IR1
DIETHYL BENZYLIDENEMALONATE(5292-53-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Diethyl benzylidenemalonate, 98%(5292-53-5)
[Sigma Aldrich]

5292-53-5(sigmaaldrich)
[TCI AMERICA]

Diethyl Benzylidenemalonate,>96.0%(GC)(5292-53-5)
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