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About This Item
Linear Formula:
C6H5CH(COOC2H5)2
CAS Number:
Molecular Weight:
236.26
Beilstein:
614465
EC Number:
MDL number:
UNSPSC Code:
12352100
eCl@ss:
39024637
PubChem Substance ID:
NACRES:
NA.22
Assay
98%
refractive index
n20/D 1.491 (lit.)
bp
170-172 °C/14 mmHg (lit.)
mp
16 °C (lit.)
density
1.095 g/mL at 25 °C (lit.)
functional group
ester
phenyl
SMILES string
CCOC(=O)C(C(=O)OCC)c1ccccc1
InChI
1S/C13H16O4/c1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3
InChI key
FGYDHYCFHBSNPE-UHFFFAOYSA-N
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General description
Diethyl phenylmalonate was partially hydrolysed to the corresponding chiral monoester by various immobilized preparations of lipase from Thermomyces lanuginosa.
Application
Diethyl phenylmalonate was used in the synthesis of felbamate-d4 (2-phenyl-1,3-propanediol-l,l,3,3-d4 dicarbamate) using lithium aluminum deuteride.
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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