2-Ethynyl-5,5-Dimethyl-2-Cyclohexen-1-One
[CAS# 271572-53-3]

Identification

• Name: 2-Ethynyl-5,5-Dimethyl-2-Cyclohexen-1-One
• Synonyms: 2-ethynyl-5,5-dimethylcyclohex-2-enone
• Molecular Formula: C₁₀H₁₂O
• Molecular Weight: 148.20
• CAS Registry Number: 271572-53-3
• SMILES: CC1(CC=C(C(=O)C1)C#C)C
• InChI: 1S/C10H12O/c1-4-8-5-6-10(2,3)7-9(8)11/h1,5H,6-7H2,2-3H3
• InChIKey: SOVFNSZFDZDXPB-UHFFFAOYSA-N

Properties

• Density: 0.983g/cm³ (Cal.)
• Boiling point: 216.943°C at 760 mmHg (Cal.)
• Flash point: 80.647°C (Cal.)
• Refractive index: 1.494 (Cal.)