1041847-71-5

Basic information

• Product Name: [NMe₂(2-propynyl)(CH=C(CH₃)2)][OTS]
• Synonyms: [NMe₂(2-propynyl)(CH=C(CH₃)2)][OTS]
• CAS NO: 1041847-71-5
• Molecular Weight: 309.43
• Mol File: 1041847-71-5.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: [NMe₂(2-propynyl)(CH=C(CH₃)2)][OTS](CAS DataBase Reference)
• NIST Chemistry Reference: [NMe₂(2-propynyl)(CH=C(CH₃)2)][OTS](1041847-71-5)
• EPA Substance Registry System: [NMe₂(2-propynyl)(CH=C(CH₃)2)][OTS](1041847-71-5)

Safety Data

• Hazardous Substances Data: 1041847-71-5(Hazardous Substances Data)

Upstream product

• 6906-32-7 N,N,2-Trimethyl-1-propen-1-amin 
• 6165-76-0 propargyl p-toluenesulfonate 

Downstream Products

• 4058-51-9 2,2-dimethyl-3,4-pentadienal 

Relevant articles and documents

Aza cope rearrangement of propargyl enammonium cations catalyzed by a self-assembled "nanozyme"

The tetrahedral assembly [Ga4L6]12- [L = N,N-bis(2,3-dihydroxybenzoyl)-1,5-diaminonaphthalene) encapsulates a variety of cations, including propargyl enammonium cations capable of undergoing the aza Cope rearrangement. For propargyl enammonium substrates that are encapsulated in the [Ga4L6]12- assembly, rate accelerations by factors of up to 184 compared with the background reaction rate were observed. After rearrangement, the product iminium ion is released into solution and hydrolyzed, allowing for catalytic turnover. The activation parameters for the catalyzed and uncatalyzed reaction were determined, revealing that a decrease in the entropy of activation is responsible for the observed rate enhancements. The catalyzed reaction exhibits saturation kinetics: the rate data obeyed the Michaelis-Menten model of enzyme kinetics, and competitive inhibition using a nonreactive guest was demonstrated.