4-[2-Methyl-3-(4-Chlorobenzoyl)Phenyl]Butanoic Acid
[CAS# 41651-99-4]

Identification

• Name: 4-[2-Methyl-3-(4-Chlorobenzoyl)Phenyl]Butanoic Acid
• Synonyms: 4-[3-(4-Chlorobenzoyl)-2-Methyl-Phenyl]Butanoic Acid; 4-[3-[(4-Chlorophenyl)-Oxomethyl]-2-Methylphenyl]Butanoic Acid; 4-[3-(4-Chlorobenzoyl)-2-Methyl-Phenyl]Butyric Acid
• Molecular Formula: C₁₈H₁₇ClO₃
• Molecular Weight: 316.78
• CAS Registry Number: 41651-99-4
• SMILES: C2=C(C(=O)C1=CC=C(Cl)C=C1)C(=C(C=C2)CCCC(=O)O)C
• InChI: 1S/C18H17ClO3/c1-12-13(5-3-7-17(20)21)4-2-6-16(12)18(22)14-8-10-15(19)11-9-14/h2,4,6,8-11H,3,5,7H2,1H3,(H,20,21)
• InChIKey: IFJDHARPMATWIG-UHFFFAOYSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 480.263°C at 760 mmHg (Cal.)
• Flash point: 244.255°C (Cal.)