4-[[(6-Chloro-4-Oxo-4H-1-Benzopyran-2-Yl)Carbonyl]Amino]Benzoic Acid
[CAS# 27455-38-5]

Identification

• Name: 4-[[(6-Chloro-4-Oxo-4H-1-Benzopyran-2-Yl)Carbonyl]Amino]Benzoic Acid
• Synonyms: 4-[(6-Chloro-4-Oxo-Chromene-2-Carbonyl)Amino]Benzoic Acid; 4-[[(6-Chloro-4-Oxo-2-Chromenyl)-Oxomethyl]Amino]Benzoic Acid; 4-[(6-Chloro-4-Keto-Chromene-2-Carbonyl)Amino]Benzoic Acid
• Molecular Formula: C₁₇H₁₀ClNO₅
• Molecular Weight: 343.72
• CAS Registry Number: 27455-38-5
• SMILES: C1=C(C=CC2=C1C(C=C(O2)C(NC3=CC=C(C=C3)C(O)=O)=O)=O)Cl
• InChI: 1S/C17H10ClNO5/c18-10-3-6-14-12(7-10)13(20)8-15(24-14)16(21)19-11-4-1-9(2-5-11)17(22)23/h1-8H,(H,19,21)(H,22,23)
• InChIKey: SRXKTPVLXFSRIH-UHFFFAOYSA-N

Properties

• Density: 1.576g/cm³ (Cal.)
• Boiling point: 610.477°C at 760 mmHg (Cal.)
• Flash point: 323.005°C (Cal.)