(E)-4-(1-Hydroxy-4,7-Dimethyl-1,4a,5,6,7,7a-Hexahydrocyclopenta[d]Pyran-3-Yl)But-3-En-2-One
[CAS# 39013-24-6]

Identification

• Name: (E)-4-(1-Hydroxy-4,7-Dimethyl-1,4a,5,6,7,7a-Hexahydrocyclopenta[d]Pyran-3-Yl)But-3-En-2-One
• Synonyms: 3-Buten-2-One, 4-(1,4A,5,6,7,7A-Hexahydro-1-Hydroxy-4,7-Dimethylcyclopenta(C)Pyran-3-Yl)-; Gyrinidone
• Molecular Formula: C₁₄H₂₀O₃
• Molecular Weight: 236.31
• CAS Registry Number: 39013-24-6
• SMILES: CC1=C(OC(C2C(C)CCC12)O)/C=C/C(=O)C
• InChI: 1S/C14H20O3/c1-8-4-6-11-10(3)12(7-5-9(2)15)17-14(16)13(8)11/h5,7-8,11,13-14,16H,4,6H2,1-3H3/b7-5+
• InChIKey: SSFLZIBVARYADM-FNORWQNLSA-N

Properties

• Density: 1.139g/cm³ (Cal.)
• Boiling point: 383.273°C at 760 mmHg (Cal.)
• Flash point: 141.78°C (Cal.)