3-Chloro-1-[4-(2-Methyl-2-Propanyl)Phenyl]-1-Propanone
[CAS# 28547-33-3]

Identification

• Name: 3-Chloro-1-[4-(2-Methyl-2-Propanyl)Phenyl]-1-Propanone
• Synonyms: 1-(4-t-Butyl phenyl)-3-chloropropan-1-one; 1-(4-t-butylphenyl)-3-chloropropan-1-one; 1-Propanone,3-chloro-1-[4-(1,1-dimethylethyl)phenyl]-
• Molecular Formula: C₁₃H₁₇ClO
• Molecular Weight: 224.73
• CAS Registry Number: 28547-33-3
• SMILES: CC(C)(C)c1ccc(cc1)C(=O)CCCl
• InChI: 1S/C13H17ClO/c1-13(2,3)11-6-4-10(5-7-11)12(15)8-9-14/h4-7H,8-9H2,1-3H3
• InChIKey: RWKVKFPYVTZRHS-UHFFFAOYSA-N

Properties

• Density: 1.043g/cm³ (Cal.)
• Boiling point: 327.399°C at 760 mmHg (Cal.)
• Flash point: 190.296°C (Cal.)
• Refractive index: 1.507 (Cal.)