2,4,4-Trimethyl-2-Cyclohexen-1-One
[CAS# 13395-71-6]

Identification

• Name: 2,4,4-Trimethyl-2-Cyclohexen-1-One
• Synonyms: 2,4,4-trimethylcyclohex-2-en-1-one; ghl.PD_Mitscherleg0.89
• Molecular Formula: C₉H₁₄O
• Molecular Weight: 138.21
• CAS Registry Number: 13395-71-6
• SMILES: O=C1\C(=C/C(C)(C)CC1)C
• InChI: 1S/C9H14O/c1-7-6-9(2,3)5-4-8(7)10/h6H,4-5H2,1-3H3
• InChIKey: VIBRIVSJBYFUNF-UHFFFAOYSA-N

Properties

• Density: 0.905g/cm³ (Cal.)
• Boiling point: 196.93°C at 760 mmHg (Cal.)
• Flash point: 66.111°C (Cal.)
• Refractive index: 1.455 (Cal.)