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29540-54-3

29540-54-3 Structure

29540-54-3 Structure
IdentificationBack Directory
[Name]

a-Methyl-b-oxo-benzenepropanoic acid methyl ester
[CAS]

29540-54-3
[Synonyms]

Methyl 2-methyl-3-oxo-3-phenyl-propanoate
a-Methyl-b-oxo-benzenepropanoic acid methyl ester
Benzenepropanoic acid, α-methyl-β-oxo-, methyl ester
[Molecular Formula]

C11H12O3
[MDL Number]

MFCD00956709
[MOL File]

29540-54-3.mol
[Molecular Weight]

192.211
Chemical PropertiesBack Directory
[Boiling point ]

144 °C(Press: 10 Torr)
[density ]

1.113 g/cm3
[storage temp. ]

-20°C Freezer
[solubility ]

Dichloromethane
[form ]

Oil
[pka]

10.91±0.26(Predicted)
[color ]

Yellow
Safety DataBack Directory
[HS Code ]

2918300090
Hazard InformationBack Directory
[Uses]

Methyl 2-Methyl-3-oxo-3-phenylpropanoate is an intermediate in the synthesis of Pyrametostrobin (P847010), a novel fungicide. Also, it is derived from 1-Methyl-2-nitrobenzene (N572306), which is a toxic pollutant of the environment because of its large scale use in the production of explosives. It is a useful synthetic intermediate. It shows carcinogenic activity in rats.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 48, p. 3833, 1983 DOI: 10.1021/jo00169a053
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