452096-18-3

Basic information

• Product Name: Acetonitrile, [[(1S,2R)-2-chloro-1-methyl-2-phenylethyl]methylamino]-
• CAS NO: 452096-18-3
• Molecular Formula: C12H15ClN2
• Molecular Weight: 222.718
• Mol File: 452096-18-3.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: Acetonitrile, [[(1S,2R)-2-chloro-1-methyl-2-phenylethyl]methylamino]-(CAS DataBase Reference)
• NIST Chemistry Reference: Acetonitrile, [[(1S,2R)-2-chloro-1-methyl-2-phenylethyl]methylamino]-(452096-18-3)
• EPA Substance Registry System: Acetonitrile, [[(1S,2R)-2-chloro-1-methyl-2-phenylethyl]methylamino]-(452096-18-3)

Safety Data

• Hazardous Substances Data: 452096-18-3(Hazardous Substances Data)

Upstream product

• 299-42-3 ephedrine 
• 182047-93-4 (1R,2S)-N-cyanomethyl-ephedrine 

Downstream Products

• 1613740-64-9 (1S,2R)-{[2-(3-Methyl-1H-indol-2-yl)-1-methyl-2-phenyl-ethyl]-methyl-amino}-acetonitrile 
• 1613740-62-7 (1S,2S)-{[2-(2-Methyl-1H-indol-3-yl)-1-methyl-2-phenyl-ethyl]-methyl-amino}-acetonitrile 
• 1613740-68-3 (3R,4S)-6-chloro-2,3-methyl-4-phenyl-1,2,3,4-tetrahydro-β-carboline 
• 1613740-69-4 C₁₉H₁₉ClN₂ 
• 1613740-60-5 2-((1S,2S)-{[2-(5-chloro-1H-indol-3-yl)-1-methyl-2-phenylethyl]methylamino})acetonitrile 
• 1613740-73-0 (3S,4R)-6-Methoxy-2,3-methyl-4-phenyl-1,2,3,4-tetrahydro-β-carboline 
• 1613740-59-2 {[(1S,2R)2-(5-methoxy-1H-indol-3-yl)-1-methyl-2-phenylethyl]methylamino}acetonitrile 
• 1613740-58-1 {[(1S,2S)2-(5-methoxy-1H-indol-3-yl)-1-methyl-2-phenylethyl]methylamino}acetonitrile 

Relevant articles and documents

A straightforward synthesis of enantiopure 2-cyano azetidines from β-amino alcohols

Enantiopure 2-cyano azetidines were prepared in high yields from β-amino alcohols. This synthesis was shown to be general and is based on two important steps: (i) chlorination of a N-cyanomethylated β-amino alcohol and (ii) a 4-exo-trig ring closure through the alkylation of a lithiated α-amino nitrile. The former step is stereoselective when ephedrine-derived β-amino alcohols are used. In the case of a phenylglycinol-derived β-amino alcohol, this step also involves a rearrangement.