4-(4-Chlorophenyl)-2-(4-methylphenyl)-4-oxobutanoic acid
[CAS# 70596-90-6]

Identification

• Name: 4-(4-Chlorophenyl)-2-(4-methylphenyl)-4-oxobutanoic acid
• Synonyms: 4-(4-Chlorophenyl)-2-(4-methylphenyl)-4-oxobutanoic acid; 4-(4-CHLOROPHENYL)-2-(4-METHYLPHENYL)-4-OXOBUTANOICACID; 4-(4-chlorophenyl)-4-oxo-2-(p-tolyl)butanoic acid
• Molecular Formula: C₁₇H₁₅ClO₃
• Molecular Weight: 302.75
• CAS Registry Number: 70596-90-6
• SMILES: CC1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O
• InChI: 1S/C17H15ClO3/c1-11-2-4-12(5-3-11)15(17(20)21)10-16(19)13-6-8-14(18)9-7-13/h2-9,15H,10H2,1H3,(H,20,21)
• InChIKey: KWNBDPJHEKVDAW-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 185-188°C (Expl.)
• Boiling point: 506.1±50.0°C at 760 mmHg (Cal.)
• Flash point: 259.9±30.1°C (Cal.)

Safety Data

• Safety Description: IRRITANT