2-[4-(Dimethylamino)Benzoyl]Benzoic Acid
[CAS# 21528-31-4]

Identification

• Name: 2-[4-(Dimethylamino)Benzoyl]Benzoic Acid
• Synonyms: 2-[(4-Dimethylaminophenyl)-Oxomethyl]Benzoic Acid; 2-(4-Dimethylaminophenyl)Carbonylbenzoic Acid; 2-(4-(Dimethylamino)Benzoyl)Benzoic Acid
• Molecular Formula: C₁₆H₁₅NO₃
• Molecular Weight: 269.30
• CAS Registry Number: 21528-31-4
• EINECS: 244-423-0
• SMILES: C1=C(C(=CC=C1)C(O)=O)C(C2=CC=C(C=C2)N(C)C)=O
• InChI: 1S/C16H15NO3/c1-17(2)12-9-7-11(8-10-12)15(18)13-5-3-4-6-14(13)16(19)20/h3-10H,1-2H3,(H,19,20)
• InChIKey: KAWOFQZCZFQCSH-UHFFFAOYSA-N

Properties

• Density: 1.235g/cm³ (Cal.)
• Boiling point: 487.458°C at 760 mmHg (Cal.)
• Flash point: 248.606°C (Cal.)

References

• (1): Arnoldi Anna, Bassoli Angela, Borgonovo Gigliola, Merlini Lucio, Morini Gabriella. Synthesis and Structure−Activity Relationships of Sweet 2-Benzoylbenzoic Acid Derivatives, Journal of Agricultural and Food Chemistry, 1997