3-[1-(4-Chlorophenyl)-3-oxobutyl]-2-hydroxy-4H-chromen-4-one
[CAS# 86508-37-4]

Identification

• Name: 3-[1-(4-Chlorophenyl)-3-oxobutyl]-2-hydroxy-4H-chromen-4-one
• Synonyms: 2H-1-Benzopyran-2-one, 3-(1-(4-chlorophenyl)-3-oxobutyl)-4-hydroxy- (9CI); 2H-1-benzopyran-2-one, 3-[1-(4-chlorophenyl)-3-oxobutyl]-4-hydroxy-; 3-(1-(4-Chloorfenyl)-3-oxo-butyl)-4-hydroxy-cumarine
• Molecular Formula: C₁₉H₁₅ClO₄
• Molecular Weight: 342.77
• CAS Registry Number: 86508-37-4
• SMILES: Clc1ccc(cc1)C(C=2C(=O)c3c(OC=2O)cccc3)CC(=O)C
• InChI: 1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,23H,10H2,1H3
• InChIKey: HENZOLWOIZODCT-UHFFFAOYSA-N

Properties

• Density: 1.384g/cm³ (Cal.)
• Boiling point: 499.557°C at 760 mmHg (Cal.)
• Flash point: 255.923°C (Cal.)