ChemicalBook--->CAS DataBase List--->607-81-8

607-81-8

607-81-8 Structure

607-81-8 Structure
IdentificationMore
[Name]

Diethyl benzylmalonate
[CAS]

607-81-8
[Synonyms]

AKOS BBS-00006590
BENZYLMALONIC ACID DIETHYL ESTER
DIETHYL BENZYLMALONATE
(phenylmethyl)-propanedioicacidiethylester
Diethyl 2-benzylmalonate
Malonic acid, 2-benzyl-, diethyl ester
Malonic acid, benzyl-, diethyl ester
Diethyl benzylmalonate,97%
Propanedioic acid, (phenylmethyl)-, diethyl ester
(phenylmethyl)-propanedioic acid diethyl ester
benzyl-propanedioic acid diethyl ester
1,1-Bis(ethoxycarbonyl)-2-phenylethane
2-Benzylmalonic acid diethyl ester
NSC 41169
NSC 631631
NSC 8720
2-Benzylpropanedioic acid diethyl ester
2-Phenylethane-1,1-dicarboxylic acid diethyl ester
[EINECS(EC#)]

210-142-7
[Molecular Formula]

C14H18O4
[MDL Number]

MFCD00009166
[Molecular Weight]

250.29
[MOL File]

607-81-8.mol
Chemical PropertiesBack Directory
[Appearance]

Colourless Liquid
[Boiling point ]

162-163 °C/10 mmHg (lit.)
[density ]

1.064 g/mL at 25 °C(lit.)
[vapor pressure ]

0.26Pa at 25℃
[refractive index ]

n20/D 1.486(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform, Methanol
[form ]

Colourless Liquid
[pka]

12.56±0.46(Predicted)
[color ]

Colorless to Almost colorless
[Water Solubility ]

immiscible
[BRN ]

615793
[InChIKey]

ICZLTZWATFXDLP-UHFFFAOYSA-N
[LogP]

2.76
[CAS DataBase Reference]

607-81-8(CAS DataBase Reference)
[NIST Chemistry Reference]

Propanedioic acid, (phenylmethyl)-, diethyl ester(607-81-8)
[EPA Substance Registry System]

607-81-8(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29173980
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Potassium carbonate-->Malonic acid-->Benzyl bromide-->Ammonium bromide
[Preparation Products]

Diethyl(acetylamino)((2-((bis(2-hydroxyethyl)amino)methyl)-5-nitrophenyl)methyl)propanedioate-->DIETHYL 2-(ACETAMIDO)-2-(2-(BROMOMETHYL)-5-NITROBENZYL)MALONATE-->Diethyl(acetylamino)((2-((bis(2-chloroethyl)amino)methyl)-5-nitrophenyl)methyl)propanedioate-->4-Hydroxy-3-benzylcoumarin-->2-Benzylacrylic acid-->2-[2-(DiMethylaMino)ethyl]-1-indanone-->Benzylmalonic acid-->3-benzylpentanedioic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Diethyl benzylmalonate(607-81-8).msds
Hazard InformationBack Directory
[Chemical Properties]

Colourless Liquid
[Uses]

Diethyl Benzylmalonate (cas# 607-81-8) is a compound useful in organic synthesis.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 31, p. 620, 1966 DOI: 10.1021/jo01340a523
[General Description]

Diethyl benzylmalonate on condensation with 2-amino-benzimidazole yields 3-benzyl-4-hydroxypyrimido[1,2-a]benzimidazole-2-one.
Spectrum DetailBack Directory
[Spectrum Detail]

Diethyl benzylmalonate(607-81-8)MS
Diethyl benzylmalonate(607-81-8)1HNMR
Diethyl benzylmalonate(607-81-8)13CNMR
Diethyl benzylmalonate(607-81-8)IR1
Diethyl benzylmalonate(607-81-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Diethyl benzylmalonate, 97%(607-81-8)
[Alfa Aesar]

Diethyl benzylmalonate, 97%(607-81-8)
[Sigma Aldrich]

607-81-8(sigmaaldrich)
[TCI AMERICA]

Diethyl Benzylmalonate,>98.0%(GC)(607-81-8)
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