(E)-4-(6-Bicyclo[2.2.1]Heptanyl)-3-Methylbut-3-En-2-One
[CAS# 72727-67-4]

Identification

• Name: (E)-4-(6-Bicyclo[2.2.1]Heptanyl)-3-Methylbut-3-En-2-One
• Synonyms: (E)-3-Methyl-4-Norbornan-2-Yl-But-3-En-2-One; (E)-3-Methyl-4-(2-Norbornanyl)But-3-En-2-One; (E)-3-Methyl-4-(2-Norbornyl)But-3-En-2-One
• Molecular Formula: C₁₂H₁₈O
• Molecular Weight: 178.27
• CAS Registry Number: 72727-67-4
• EINECS: 276-800-0
• SMILES: C\C(=C/C1C2CC(C1)CC2)C(=O)C
• InChI: 1S/C12H18O/c1-8(9(2)13)5-12-7-10-3-4-11(12)6-10/h5,10-12H,3-4,6-7H2,1-2H3/b8-5+
• InChIKey: SVXXTRPQQQPJMI-VMPITWQZSA-N

Properties

• Density: 1.042g/cm³ (Cal.)
• Boiling point: 273.456°C at 760 mmHg (Cal.)
• Flash point: 115.449°C (Cal.)