1-(4-Bromophenyl)-2,2-dimethyl-1-butanone
[CAS# 898765-37-2]

Identification

• Name: 1-(4-Bromophenyl)-2,2-dimethyl-1-butanone
• Synonyms: 4'-bromo-2,2-dimethylbutyrophenone
• Molecular Formula: C₁₂H₁₅BrO
• Molecular Weight: 255.15
• CAS Registry Number: 898765-37-2
• SMILES: O=C(c1ccc(Br)cc1)C(C)(C)CC
• InChI: 1S/C12H15BrO/c1-4-12(2,3)11(14)9-5-7-10(13)8-6-9/h5-8H,4H2,1-3H3
• InChIKey: AOTFOLPFYOXBNI-UHFFFAOYSA-N

Properties

• Density: 1.256g/cm³ (Cal.)
• Boiling point: 309.569°C at 760 mmHg (Cal.)
• Flash point: 39.348°C (Cal.)
• Refractive index: 1.526 (Cal.)