158568-64-0

Basic information

• Product Name: 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)
• Synonyms: (S)-3-(mercaptomethyl)quinuclidin-3-ol;1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI);(S)-3-Hydroxy-3-mercaptomethylquinuclidine
• CAS NO: 158568-64-0
• Molecular Formula: C8H15NOS
• Molecular Weight: 173.28
• Mol File: 158568-64-0.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 286.0±15.0 °C(Predicted)
• Appearance: /
• Density: 1.21±0.1 g/cm3(Predicted)
• PKA: 10.18±0.10(Predicted)
• CAS DataBase Reference: 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)(158568-64-0)
• EPA Substance Registry System: 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)(158568-64-0)

Safety Data

• Hazardous Substances Data: 158568-64-0(Hazardous Substances Data)

Usage

General Description

1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) is a chemical compound with a complex molecular structure. It is a chiral compound, meaning it has a non-superimposable mirror image, and the (S)-enantiomer specifically refers to its stereochemical configuration. 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) contains a sulfur atom in its structure, which gives it thiol functionality and makes it potentially reactive in certain chemical reactions. 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) may have applications in organic synthesis, pharmaceutical chemistry, or other industrial processes, but its specific uses and properties would depend on further research and testing. Overall, 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) is a complex and potentially versatile chemical compound with various potential uses in different industries.

Upstream product

• 64168-68-9 Spiro- Hydrochlorid 
• 1193-65-3 3-quinuclidinone hydrochloride 
• 1435450-21-7 C₉H₁₃NO₂S 
• 1435450-13-7 C₈H₁₄BrNO*BrH 
• 41353-91-7 1’-azaspiro[oxirane-2,3’-bicyclo[2.2.2]octane] 
• 158469-70-6 4-(2-hydroxy-1-oxoethyl)-1-piperidinecarboxylic acid (1,1-dimethylethyl)ester 
• 158469-71-7 4-<(2-hydroxy-1-methylene)ethyl>-1-piperidinecarboxylic acid(1,1-dimethylethyl) ester 
• 124620-88-8 2-methylspiro(1,3-oxathiolane-5,3'-quinuclidine) 
• 158469-74-0 4-<(S)-2-benzylthio-1-hydroxy-1-<<(methanesulfonyl)oxy>methyl>ethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester 
• 158469-75-1 (S)-3-hydroxy-3-benzylthiomethylquinuclidine 
• 158469-73-9 4-<(S)-2-benzylthio-1-hydroxy-1-hydroxymethylethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester 
• 158469-72-8 4-<(S)-2-hydroxymethyl-2-oxiranyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester 

Downstream Products

• 107220-27-9 trans-cevimeline 
• 107220-27-9 cevimeline 
• 173553-37-2 Cevimeline hydrochloride 

Relevant articles and documents

A new route to cevimeline

The present work demonstrates a new route for the synthesis of cevimeline in which safe and odorless thiourea is utilized as a thiolating reagent.

Method for producing 2-methylspiro(1,3-oxathiolane-5,3')quinuclidine

A method for producing 2-methylspiro(1,3-oxathiolane-5,3')quinuclidine, which comprises reacting 3-hydroxy-3-mercaptomethylquinuclidine or a salt thereof and a carbonyl compound in the presence of a catalyst made of at least one member selected from the group consisting of tin halides, oxyacids of phosphorus, phosphorus oxyhalides and organic sulfonic acids, to produce cis-form 2-methylspiro(1,3-oxathiolane-5,3')quinuclidine or a salt thereof.