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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

IUPAC name:
diethyl phenylmalonate

Inventory

EC number:
201-456-5
EC name:
Diethyl phenylmalonate
CAS number:
83-13-6
CAS number:
83-13-6
Synonyms
Names:
Propanedioic acid, phenyl-, diethyl ester
diethyl_phenylmalonate
Identifier:
IUPAC name
diethyl phenylmalonate
Identifier:
other: SMILES notation
CCOC(=O)C(C(=O)OCC)c1ccccc1
phenyl-propanedioic acid diethyl ester

Molecular and structural information

Molecular formula:
C13H16O4
Molecular weight:
236.27
SMILES notation:
O=C(OCC)C(c(cccc1)c1)C(=O)OCC
InChl:
InChI=1/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
Structural formula:
Chemical structure

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