4-Tert-Butyl-2,2,2-Trichloroacetophenone
[CAS# 51326-37-5]

Identification

• Name: 4-Tert-Butyl-2,2,2-Trichloroacetophenone
• Synonyms: 1-(4-Tert-Butylphenyl)-2,2,2-Trichloro-Ethanone; 2,2,2-Trichloro-1-(4-(1,1-Dimethylethyl)Phenyl)Ethan-1-One; 2,2,2-Trichloro-4-Tert-Butyl Acetophenone
• Molecular Formula: C₁₂H₁₃Cl₃O
• Molecular Weight: 279.59
• CAS Registry Number: 51326-37-5
• EINECS: 257-138-1
• SMILES: C1=CC(=CC=C1C(C(Cl)(Cl)Cl)=O)C(C)(C)C
• InChI: 1S/C12H13Cl3O/c1-11(2,3)9-6-4-8(5-7-9)10(16)12(13,14)15/h4-7H,1-3H3
• InChIKey: IMDHDEPPVWETOI-UHFFFAOYSA-N

Properties

• Density: 1.26g/cm³ (Cal.)
• Boiling point: 322.38°C at 760 mmHg (Cal.)
• Flash point: 135.686°C (Cal.)