1-(4-Bromo-2-fluorophenyl)-3,3-dimethyl-1-butanone
[CAS# 898764-78-8]

Identification

• Name: 1-(4-Bromo-2-fluorophenyl)-3,3-dimethyl-1-butanone
• Synonyms: 4'-Bromo-3,3-dimethyl-2'-fluorobutyrophenone
• Molecular Formula: C₁₂H₁₄BrFO
• Molecular Weight: 273.14
• CAS Registry Number: 898764-78-8
• SMILES: O=C(CC(C)(C)C)c1ccc(Br)cc1F
• InChI: 1S/C12H14BrFO/c1-12(2,3)7-11(15)9-5-4-8(13)6-10(9)14/h4-6H,7H2,1-3H3
• InChIKey: JZEMVTKCATWAES-UHFFFAOYSA-N

Properties

• Density: 1.317g/cm³ (Cal.)
• Boiling point: 307.563°C at 760 mmHg (Cal.)
• Flash point: 139.809°C (Cal.)
• Refractive index: 1.514 (Cal.)