3-[(4-Chlorobenzoyl)-(2,6-Dimethylphenyl)Amino]Propanoic Acid
[CAS# 30544-73-1]

Identification

• Name: 3-[(4-Chlorobenzoyl)-(2,6-Dimethylphenyl)Amino]Propanoic Acid
• Synonyms: 3-[[(4-Chlorophenyl)-Oxomethyl]-(2,6-Dimethylphenyl)Amino]Propanoic Acid; 3-[(4-Chlorobenzoyl)-(2,6-Dimethylphenyl)Amino]Propionic Acid; 3-[(4-Chlorophenyl)Carbonyl-(2,6-Dimethylphenyl)Amino]Propanoic Acid
• Molecular Formula: C₁₈H₁₈ClNO₃
• Molecular Weight: 331.80
• CAS Registry Number: 30544-73-1
• SMILES: C1=CC=C(C(=C1C)N(C(C2=CC=C(C=C2)Cl)=O)CCC(O)=O)C
• InChI: 1S/C18H18ClNO3/c1-12-4-3-5-13(2)17(12)20(11-10-16(21)22)18(23)14-6-8-15(19)9-7-14/h3-9H,10-11H2,1-2H3,(H,21,22)
• InChIKey: QNHUFJPPCSTYBX-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)
• Boiling point: 521.595°C at 760 mmHg (Cal.)
• Flash point: 269.251°C (Cal.)