66164-74-7

Basic information

• Product Name: 2,4,4-Trimethyl-2-phenylthiopent-3-on
• CAS NO: 66164-74-7
• Molecular Weight: 236.378
• Mol File: 66164-74-7.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: 2,4,4-Trimethyl-2-phenylthiopent-3-on(CAS DataBase Reference)
• NIST Chemistry Reference: 2,4,4-Trimethyl-2-phenylthiopent-3-on(66164-74-7)
• EPA Substance Registry System: 2,4,4-Trimethyl-2-phenylthiopent-3-on(66164-74-7)

Safety Data

• Hazardous Substances Data: 66164-74-7(Hazardous Substances Data)

Upstream product

• 34757-17-0 ethyl 2,2-dibromopropanoate 
• 37471-41-3 3,3-dimethyl-1-(phenylthio)butan-2-one 
• 74-88-4 methyl iodide 

Downstream Products

• 66164-73-6 2,4,4-Trimethyl-2-phenylthiopent-3-ol 
• 66164-75-8 2,4,4-Trimethyl-3-phenylthiopent-2-en 

Relevant articles and documents

The effects of C-S and C-Se bonds on torquoselectivity: stereoselective olefination of α-thio and α-selenoketones with ynolates

Highly Z-selective olefination of acyclic α-thio and α-selenoketones with ynolates has been achieved, and the theoretical calculations of the transition states in the ring-opening of the intermediates, the β-lactone enolates, revealed that the torquoselectivity was controlled by the secondary orbital interactions between the σ orbital of the C-S bond or a lone pair orbital on the S and σ* orbitals of the breaking C-O bond, and the σ orbital of the breaking C-O bond or a lone pair orbital on the O on the ring and the σ* orbitals of the C-S bond. The synthetic applications of the resulting olefins are also shown.