4-Fluoro-4-Isopropyl-3-Methyl-2,5-Cyclohexadien-1-One
[CAS# 246228-99-9]

Identification

• Name: 4-Fluoro-4-Isopropyl-3-Methyl-2,5-Cyclohexadien-1-One
• Synonyms: 4-fluoro-4-isopropyl-3-methylcyclohexa-2,5-dienone
• Molecular Formula: C₁₀H₁₃FO
• Molecular Weight: 168.21
• CAS Registry Number: 246228-99-9
• SMILES: CC1=CC(=O)C=CC1(C(C)C)F
• InChI: 1S/C10H13FO/c1-7(2)10(11)5-4-9(12)6-8(10)3/h4-7H,1-3H3
• InChIKey: BUMRSWFFQYGAHD-UHFFFAOYSA-N

Properties

• Density: 1.019g/cm³ (Cal.)
• Boiling point: 217.54°C at 760 mmHg (Cal.)
• Flash point: 99.741°C (Cal.)
• Refractive index: 1.471 (Cal.)