6-[(E)-3-Hydroxy-3-Methyl-1-Butenyl]-7-Methoxy-2H-1-Benzopyran-2-One
[CAS# 18529-47-0]

Identification

• Name: 6-[(E)-3-Hydroxy-3-Methyl-1-Butenyl]-7-Methoxy-2H-1-Benzopyran-2-One
• Synonyms: 6-[(E)-3-Hydroxy-3-Methyl-But-1-Enyl]-7-Methoxy-Chromen-2-One; 6-[(E)-3-Hydroxy-3-Methylbut-1-Enyl]-7-Methoxy-2-Chromenone; 6-[(E)-3-Hydroxy-3-Methyl-But-1-Enyl]-7-Methoxy-Coumarin
• Molecular Formula: C₁₅H₁₆O₄
• Molecular Weight: 260.29
• CAS Registry Number: 18529-47-0
• SMILES: C1=C(C(=CC2=C1OC(C=C2)=O)/C=C/C(O)(C)C)OC
• InChI: 1S/C15H16O4/c1-15(2,17)7-6-11-8-10-4-5-14(16)19-13(10)9-12(11)18-3/h4-9,17H,1-3H3/b7-6+
• InChIKey: LNFVZUMSDAIQDQ-VOTSOKGWSA-N

Properties

• Density: 1.224g/cm³ (Cal.)
• Boiling point: 466.892°C at 760 mmHg (Cal.)
• Flash point: 176.701°C (Cal.)