61088-39-9

Basic information

• Product Name: 1-Butanone, 1-(3,5-dimethylphenyl)-
• Synonyms: 1-(3,5-dimethyl-phenyl)-butan-1-one;3,5-Dimethylbutyrophenon;1-Butanone,1-(3,5-dimethylphenyl);1-(3,5-Dimethyl-phenyl)-butan-1-on
• CAS NO: 61088-39-9
• Molecular Formula: C12H16O
• Molecular Weight: 176.25500
• Mol File: 61088-39-9.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: 1-Butanone, 1-(3,5-dimethylphenyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Butanone, 1-(3,5-dimethylphenyl)-(61088-39-9)
• EPA Substance Registry System: 1-Butanone, 1-(3,5-dimethylphenyl)-(61088-39-9)

Safety Data

• Hazardous Substances Data: 61088-39-9(Hazardous Substances Data)

Upstream product

• 5905-48-6 dipropylcadmium 
• 6613-44-1 3,5-dimethylbenzoyl chloride 
• 34696-73-6 3,5-dimethyphenylmagnesium bromide 
• 109480-78-6 N-methoxy-N-methylbutanamide 
• 109-74-0 propyl cyanide 
• 22445-41-6 3,5-dimethylphenyl iodide 

Downstream Products

• 1601-74-7 1-butyl-3,5-dimethylbenzene 
• 30479-93-7 1-butyl-3,5-dimethyl-2,4,6-trinitro-benzene 
• 1588765-91-6 1-(3,5-dimethylphenyl)-2-fluorobutan-1-one 
• 1588766-67-9 2-bromo-1-(3,5-dimethylphenyl)-2-fluorobutan-1-one 
• 1588767-74-1 (S)-1-(3,5-dimethylphenyl)-2-fluoro-2-phenylbutan-1-one 

Relevant articles and documents

Iridium-Catalyzed Asymmetric Hydrogenation of α-Fluoro Ketones via a Dynamic Kinetic Resolution Strategy

The discrimination of a fluorine atom from a hydrogen atom has been challenging in asymmetric catalysis. We herein report iridium-catalyzed hydrogenation of α-fluoro ketones using a strategy of dynamic kinetic resolution. Both enantiomeric and diastereomeric selectivities were satisfactory in the preparation of β-fluoro alcohols. The DFT calculation revealed a C-F···Na charge-dipole interaction in the transition state of hydride transfer. This noncovalent interaction would be responsible for the diastereomeric control.