4-(3,3-Dimethyl-2-Norbornyl)-3-Buten-2-One
[CAS# 51468-82-7]

Identification

• Name: 4-(3,3-Dimethyl-2-Norbornyl)-3-Buten-2-One
• Synonyms: (E)-4-(6,6-Dimethyl-5-Bicyclo[2.2.1]Heptanyl)But-3-En-2-One; (E)-4-(3,3-Dimethylnorbornan-2-Yl)But-3-En-2-One; 4-(3,3-Dimethylnorbornan-2-Yl)But-3-En-2-One
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 51468-82-7
• EINECS: 257-222-8
• SMILES: CC1(C(C2CC1CC2)\C=C\C(=O)C)C
• InChI: 1S/C13H20O/c1-9(14)4-7-12-10-5-6-11(8-10)13(12,2)3/h4,7,10-12H,5-6,8H2,1-3H3/b7-4+
• InChIKey: RFOFRIOMKNGUNG-QPJJXVBHSA-N

Properties

• Density: 0.996g/cm³ (Cal.)
• Boiling point: 270.669°C at 760 mmHg (Cal.)
• Flash point: 113.876°C (Cal.)