7-Anilino-4-Methylcoumarin-3-Acetic Acid
[CAS# 82412-16-6]

Identification

• Name: 7-Anilino-4-Methylcoumarin-3-Acetic Acid
• Synonyms: 2-[4-Methyl-2-Oxo-7-(Phenylamino)-3-Chromenyl]Acetic Acid; 2-[2-Keto-4-Methyl-7-(Phenylamino)Chromen-3-Yl]Acetic Acid; 2-[4-Methyl-2-Oxo-7-(Phenylamino)Chromen-3-Yl]Ethanoic Acid
• Molecular Formula: C₁₈H₁₅NO₄
• Molecular Weight: 309.32
• CAS Registry Number: 82412-16-6
• SMILES: C2=C1OC(=O)C(=C(C1=CC=C2NC3=CC=CC=C3)C)CC(=O)O
• InChI: 1S/C18H15NO4/c1-11-14-8-7-13(19-12-5-3-2-4-6-12)9-16(14)23-18(22)15(11)10-17(20)21/h2-9,19H,10H2,1H3,(H,20,21)
• InChIKey: CQPFKBKIRKTCME-UHFFFAOYSA-N

Properties

• Density: 1.337g/cm³ (Cal.)
• Boiling point: 545.836°C at 760 mmHg (Cal.)
• Flash point: 283.912°C (Cal.)