4,6-Dihydroxy-3-(3-Oxo-1-Phenylbutyl)-2H-1-Benzopyran-2-One
[CAS 17834-02-5]

Identification

• Name: 4,6-Dihydroxy-3-(3-Oxo-1-Phenylbutyl)-2H-1-Benzopyran-2-One
• Synonyms: 2,6-Dihydroxy-3-(3-Oxo-1-Phenyl-Butyl)Chromen-4-One; 2,6-Dihydroxy-3-(3-Oxo-1-Phenylbutyl)-4-Chromenone; 2,6-Dihydroxy-3-(3-Keto-1-Phenyl-Butyl)Chromone
• Molecular Formula: C₁₉H₁₆O₅
• Molecular Weight: 324.33
• CAS Registry Number: 17834-02-5
• SMILES: C3=C(C(C1=C(OC2=C(C1=O)C=C(O)C=C2)O)CC(=O)C)C=CC=C3
• InChI: 1S/C19H16O5/c1-11(20)9-14(12-5-3-2-4-6-12)17-18(22)15-10-13(21)7-8-16(15)24-19(17)23/h2-8,10,14,21,23H,9H2,1H3
• InChIKey: JFCOGWFGPAUYNK-UHFFFAOYSA-N

Properties

• Density: 1.385g/cm³ (Cal.)
• Boiling point: 540.193°C at 760 mmHg (Cal.)
• Flash point: 197.699°C (Cal.)