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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

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Reference substances

Reference substances

Currently viewing:
IUPAC name:
methyl oxo(phenyl)acetate

Inventory

EC number:
239-263-3
EC name:
Methyl benzoylformate
CAS number:
15206-55-0
CAS number:
15206-55-0
Synonyms
Names:
Benzeneacetic acid, .alpha.-oxo-, methyl ester
Benzeneacetic acid, α-oxo-, methyl ester
Glyoxylic acid, phenyl-, methyl ester
methyl benzoylformate
Identifier:
CAS number
71833-42-6
Identifier:
IUPAC name
methyl 2-oxo-2-phenyl-acetate
Identifier:
IUPAC name
methyl 2-oxo-2-phenyl-acetatev
Identifier:
IUPAC name
methyl 2-oxo-2-phenylacetate
Identifier:
PubChem
Benzoylformic acid methyl ester
Identifier:
PubChem
Methyl 2-oxo-2-phenylacetate
Identifier:
PubChem
Methyl benzoylformate
Identifier:
PubChem
Methyl oxophenylacetate
Identifier:
PubChem
Methyl phenylglyoxylate
Identifier:
other: SMILES notation
COC(=O)C(=O)C1=CC=CC=C1
Identifier:
other: InChl
InChI=1/C14H12O/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10H,1H3
Identifier:
other: InChl
InChI=1S/C9H8O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6H,1H3
Identifier:
other: SMILES notation
O=C(OC)C(=O)c1ccccc1
methyl oxo(phenyl)acetate

Molecular and structural information

Molecular formula:
C9H8O3
Molecular weight:
164.158
SMILES notation:
COC(=O)C(=O)c1ccccc1
InChl:
InChI=1/C9H8O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6H,1H3
Structural formula:
Chemical structure

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