CAS 22027-51-6: Methyl 3-(4-methylphenyl)-3-oxopropanoate

Description: Methyl 3-(4-methylphenyl)-3-oxopropanoate, with the CAS number 22027-51-6, is an organic compound characterized by its ester functional group and a ketone moiety. It features a methyl ester derived from a propanoic acid structure, where the propanoate is substituted with a 4-methylphenyl group at the 3-position. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. It is known for its potential applications in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. The presence of the aromatic ring contributes to its stability and may influence its reactivity and solubility in various solvents. Methyl 3-(4-methylphenyl)-3-oxopropanoate may exhibit moderate to low toxicity, and safety precautions should be taken when handling it, as with many organic compounds. Its chemical properties, such as boiling point, melting point, and solubility, can vary based on environmental conditions and the presence of other substances.

Formula: C₁₁H₁₂O₃

InChI: InChI=1S/C11H12O3/c1-8-3-5-9(6-4-8)10(12)7-11(13)14-2/h3-6H,7H2,1-2H3

InChI key: InChIKey=BIKPAXOCIFGWRJ-UHFFFAOYSA-N

SMILES: O=C(OC)CC(=O)C1=CC=C(C=C1)C

Synonyms:

• 3-Oxo-3-(4-methylphenyl)propionic acid methyl ester
• 3-Oxo-3-p-tolyl-propionic acid methyl ester
• Acetic acid, p-toluoyl-, methyl ester
• Benzenepropanoic acid, 4-methyl-beta-oxo-, methyl ester
• Benzenepropanoic acid, 4-methyl-β-oxo-, methyl ester
• Methyl 3-oxo-3-(4-methylphenyl)propanoate
• Methyl 3-oxo-3-p-tolylpropanoate
• Methyl 4-methyl-β-oxobenzenepropanoate
• NSC 157310

Methyl 3-oxo-3-(p-tolyl)propanoate

CAS: 22027-51-6

• Formula: C₁₁H₁₂O₃
• Purity: 95%
• Color and Shape: Solid
• Molecular weight: 192.2112

Methyl 3-(4-methylphenyl)-3-oxopropanoate

CAS: 22027-51-6

• Purity: 95%
• Molecular weight: 192.21g/mol

3-Oxo-3-p-tolyl-propionic acid methyl ester

CAS: 22027-51-6

• Purity: 95.0%
• Color and Shape: Liquid, No data available.
• Molecular weight: 192.21400451660156

Methyl (4-methylbenzoyl)acetate

CAS: 22027-51-6

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• Formula: C₁₁H₁₂O₃
• Purity: Min. 95%
• Molecular weight: 192.21 g/mol