1-(3-Bromophenyl)-3,3-dimethyl-1-butanone
[CAS# 898764-35-7]

Identification

• Name: 1-(3-Bromophenyl)-3,3-dimethyl-1-butanone
• Synonyms: 3'-Bromo-3,3-dimethylbutyrophenone
• Molecular Formula: C₁₂H₁₅BrO
• Molecular Weight: 255.15
• CAS Registry Number: 898764-35-7
• SMILES: O=C(CC(C)(C)C)c1cc(Br)ccc1
• InChI: 1S/C12H15BrO/c1-12(2,3)8-11(14)9-5-4-6-10(13)7-9/h4-7H,8H2,1-3H3
• InChIKey: LXPVYOBEYLCMQE-UHFFFAOYSA-N

Properties

• Density: 1.256g/cm³ (Cal.)
• Boiling point: 306.164°C at 760 mmHg (Cal.)
• Flash point: 36.931°C (Cal.)
• Refractive index: 1.526 (Cal.)