3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)

Base Information

• Chemical Name: 3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)
• CAS No.: 214357-95-6
• Molecular Formula: C5H12N2
• Molecular Weight: 100.164
• Hs Code.: 2933990090
• Mol file: 214357-95-6.mol

Synonyms:(3S)-1-Methylpyrrolidin-3-amine;

Chemical Property of 3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)

Chemical Property:

• Vapor Pressure: 24.597mmHg at 25°C
• Refractive Index: 1.476
• Boiling Point: 109.63 °C at 760 mmHg
• PKA: 9.82±0.40(Predicted)
• Flash Point: 22.382 °C
• PSA: 29.26000
• Density: 0.933 g/cm³
• LogP: 0.28740
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C

Purity/Quality:

97% ^*data from raw suppliers

(3S)-1-methylpyrrolidin-3-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-Pyrrolidinamine,1-methyl-,(3S)-(9CI)

There total 1 articles about 3-Pyrrolidinamine,1-methyl-,(3S)-(9CI) which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1-methylpyrrolidin-3-one (68165-06-0) → (S)-1-methylpyrrolidin-3-ylamine (214357-95-6)

Guidance literature:

With (S)-1-phenyl-ethylamine; dimeric ω-transaminase from Halomonas elongata HeWT; In aq. phosphate buffer; at 37 ℃; for 24h; pH=8; Reagent/catalyst; Catalytic behavior; Enzymatic reaction;

DOI:10.2533/CHIMIA.2020.890

Reference yield: 94.6%

(S)-1-methylpyrrolidin-3-ylamine (214357-95-6) + 4-(6-chloropyridin-3-yl)-1-[2-cyano-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid → 4-(6-chloropyridin-3-yl)-1-[2-cyano-4-(trifluoromethyl)phenyl]-N-[(3S)-1-methylpyrrolidin-3-yl]piperidine-4-carboxamide

Guidance literature:

4-(6-chloropyridin-3-yl)-1-[2-cyano-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid; With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; at 20 ℃; for 0.0833333h;

(S)-1-methylpyrrolidin-3-ylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.166667h;

Reference yield: 86.8%

(S)-1-methylpyrrolidin-3-ylamine (214357-95-6) + 1-benzyl-4-[5-fluoro-6-(1-methyl-1H-pyrrol-2-yl)pyridine-3-yl]piperidine-4-carboxylic acid → 1-benzyl-4-[5-fluoro-6-(1-methyl-1H-pyrrol-2-yl)pyridine-3-yl]-N-[(3S)-1-methylpyrrolidin-3-yl]piperidine-4-carboxamide

Guidance literature:

With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In N,N-dimethyl-formamide; at 25 ℃; for 1h; Inert atmosphere;

upstream raw materials:

1-methylpyrrolidin-3-one