Methyl 4-(3-acetamido-2-oxopropyl)benzoate
[CAS# 77846-91-4]

Identification

• Name: Methyl 4-(3-acetamido-2-oxopropyl)benzoate
• Synonyms: Benzoic acid, 4-[3-(acetylamino)-2-oxopropyl]-, methyl ester; Methyl 4-[3-(acetylamino)-2-oxopropyl]benzoate; Methyl 4-[3-(acetylamino)-2-oxopropyl]benzoate #
• Molecular Formula: C₁₃H₁₅NO₄
• Molecular Weight: 249.26
• CAS Registry Number: 77846-91-4
• SMILES: O=C(Cc1ccc(cc1)C(=O)OC)CNC(=O)C
• InChI: 1S/C13H15NO4/c1-9(15)14-8-12(16)7-10-3-5-11(6-4-10)13(17)18-2/h3-6H,7-8H2,1-2H3,(H,14,15)
• InChIKey: YTPKXPIPNLDSGB-UHFFFAOYSA-N

Properties

• Density: 1.172g/cm³ (Cal.)
• Boiling point: 456.873°C at 760 mmHg (Cal.)
• Flash point: 230.109°C (Cal.)