7-[[(2E)-3-(4,5-Dihydro-5,5-Dimethyl-4-Oxo-2-Furanyl)-2-Buten-1-Yl]Oxy]-2H-1-Benzopyran-2-One
[CAS# 36413-91-9]

Identification

• Name: 7-[[(2E)-3-(4,5-Dihydro-5,5-Dimethyl-4-Oxo-2-Furanyl)-2-Buten-1-Yl]Oxy]-2H-1-Benzopyran-2-One
• Synonyms: 7-[3-(5,5-Dimethyl-4-Oxofuran-2-Yl)But-2-Enoxy]Chromen-2-One; 7-[3-(5,5-Dimethyl-4-Oxo-2-Furyl)But-2-Enoxy]Chromen-2-One; 7-[(E)-3-(5,5-Dimethyl-4-Oxo-2-Furyl)But-2-Enoxy]Chromen-2-One
• Molecular Formula: C₁₉H₁₈O₅
• Molecular Weight: 326.35
• CAS Registry Number: 36413-91-9
• SMILES: C1=CC(=CC2=C1C=CC(O2)=O)OC\C=C(C3=CC(=O)C(O3)(C)C)/C
• InChI: 1S/C19H18O5/c1-12(15-11-17(20)19(2,3)24-15)8-9-22-14-6-4-13-5-7-18(21)23-16(13)10-14/h4-8,10-11H,9H2,1-3H3/b12-8+
• InChIKey: OUTLLBZGJYDUQE-XYOKQWHBSA-N

Properties

• Density: 1.243g/cm³ (Cal.)
• Boiling point: 533.073°C at 760 mmHg (Cal.)
• Flash point: 304.709°C (Cal.)