1-Phenyl-3-(2,4,4-trihydroxy-1,5-cyclohexadien-1-yl)-2-propen-1-one
[CAS# 83616-07-3]

Identification

• Name: 1-Phenyl-3-(2,4,4-trihydroxy-1,5-cyclohexadien-1-yl)-2-propen-1-one
• Synonyms: 1-Phenyl-3-(2,4,4-trihydroxy-1,5-cyclohexadien-1-yl)-2-propen-1-on; 1-Phenyl-3-(2,4,4-trihydroxy-1,5-cyclohexadien-1-yl)-2-propen-1-one; 1-Phényl-3-(2,4,4-trihydroxy-1,5-cyclohexadién-1-yl)-2-propén-1-one
• Molecular Formula: C₁₅H₁₄O₄
• Molecular Weight: 258.27
• CAS Registry Number: 83616-07-3
• SMILES: c1ccc(cc1)C(=O)C=CC2=C(CC(C=C2)(O)O)O
• InChI: 1S/C15H14O4/c16-13(11-4-2-1-3-5-11)7-6-12-8-9-15(18,19)10-14(12)17/h1-9,17-19H,10H2
• InChIKey: NPRHUHYHSCCCNS-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 501.5±50.0°C at 760 mmHg (Cal.)
• Flash point: 271.2±26.6°C (Cal.)