2-(3,4-Dimethylbenzoyl)-Benzoic Acid
[CAS# 2159-42-4]

Identification

• Name: 2-(3,4-Dimethylbenzoyl)-Benzoic Acid
• Synonyms: 2-[(3,4-Dimethylphenyl)-Oxomethyl]Benzoate; 2-(3,4-Dimethylphenyl)Carbonylbenzoate; Zinc03887410
• Molecular Formula: C₁₆H₁₃O₃
• Molecular Weight: 253.28
• CAS Registry Number: 2159-42-4
• SMILES: C2=C(C(=O)C1=CC=CC=C1C([O-])=O)C=CC(=C2C)C
• InChI: 1S/C16H14O3/c1-10-7-8-12(9-11(10)2)15(17)13-5-3-4-6-14(13)16(18)19/h3-9H,1-2H3,(H,18,19)/p-1
• InChIKey: AYVFSZDAFPVJOA-UHFFFAOYSA-M

Properties

• Boiling point: 468.633°C at 760 mmHg (Cal.)
• Flash point: 251.337°C (Cal.)