(S)-(+)-3-Aminopyrrolidine dihydrochloride

Base Information

• Chemical Name: (S)-(+)-3-Aminopyrrolidine dihydrochloride
• CAS No.: 116183-83-6
• Molecular Formula: C₄H₁₀N₂*2ClH
• Molecular Weight: 159.059
• Hs Code.: 29339900
• European Community (EC) Number: 672-736-6
• DSSTox Substance ID: DTXSID20542331
• Mol file: 116183-83-6.mol

Synonyms:116183-83-6;(S)-(+)-3-Aminopyrrolidine dihydrochloride;(S)-pyrrolidin-3-amine dihydrochloride;(3S)-(+)-3-Aminopyrrolidine Dihydrochloride;(S)-3-Aminopyrrolidine 2HCl;(3S)-pyrrolidin-3-amine dihydrochloride;(3S)-pyrrolidin-3-amine;dihydrochloride;(3S)-3-aminopyrrolidine dihydrochloride;3-Pyrrolidinamine, dihydrochloride, (3S)-;MFCD00070605;(S)-3-Aminopyrrolidine dihydrochloride;(R)-(-)-3-Aminopyrrolidine dihydrochloride;SCHEMBL4717529;DTXSID20542331;(S)-pyrrolidin-3-aminedihydrochloride;AKOS015845483;AC-6713;AM81993;AS-79988;TS-02111;(S)-(+)-3-AMINOPYRROLIDINE 2HCL;A1054;(S)-PYRROLIDIN-3-YLAMINE DIHYDROCHLORIDE;EN300-2009560;(3S)-Pyrrolidin-3-amine--hydrogen chloride (1/2)

Chemical Property of (S)-(+)-3-Aminopyrrolidine dihydrochloride

Chemical Property:

• Vapor Pressure: 0.128mmHg at 25°C
• Melting Point: 283 °C
• Refractive Index: 1.1 ° (C=10, H2O)
• Boiling Point: 214.5 °C at 760 mmHg
• Flash Point: 83.5 °C
• PSA: 38.05000
• LogP: 1.94010
• Storage Temp.: Sealed in dry,Room Temperature
• Sensitive.: Hygroscopic
• Water Solubility.: very faint turbidity
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 158.0377538
• Heavy Atom Count: 8
• Complexity: 44.8

Purity/Quality:

99% ^*data from raw suppliers

(S)-(+)-3-AminopyrrolidineDihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:Irritating to eyes, respiratory system and skin.
• Hazard Codes: R36/37/38:Irritating to eyes, respiratory system and skin.
• Statements: 36/37/38
• Safety Statements: 26-36-26/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCC1N.Cl.Cl
• Isomeric SMILES: C1CNC[C@H]1N.Cl.Cl

Technology Process of (S)-(+)-3-Aminopyrrolidine dihydrochloride

There total 5 articles about (S)-(+)-3-Aminopyrrolidine dihydrochloride 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: 91.9%

(R)-pyrrolidin-3-amine (116183-82-5) → (3R)-3-aminopyrrolidine dihydrochloride (103831-11-4,116183-81-4,116183-83-6,122458-34-8)

Guidance literature:

With hydrogenchloride; In ethanol; at 10 - 40 ℃;

Reference yield: 80.5%

(3R)-3-azido-1-(phenylmethyl)pyrrolidine (116143-03-4) → (3R)-3-aminopyrrolidine dihydrochloride (103831-11-4,116183-81-4,116183-83-6,122458-34-8)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; for 2.5h; under 760 Torr;

DOI:10.1021/jm00100a028

Reference yield:

(3S)-3-azido-1-(phenylmethyl)pyrrolidine (114636-29-2) → (S)-3-aminopyrrolidine dihydrochloride (103831-11-4,116183-81-4,116183-83-6,122458-34-8)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; for 2.5h; under 760 Torr;

DOI:10.1021/jm00100a028

upstream raw materials:

(3S)-3-azido-1-(phenylmethyl)pyrrolidine

(3R)-3-azido-1-(phenylmethyl)pyrrolidine

(R)-pyrrolidin-3-amine

Downstream raw materials:

(3S)-3-amino-1-(tert-butoxycarbonyl)-pyrrolidine

1-(3-amino-4,6-difluorophenyl)-7-[(3S)-3-aminopyrrolidin-1-yl]-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid triethylamine salt

2-{[(3R)-3-aminopyrrolidin-1-yl]carbonyl}-3-[(2,4-difluorophenyl)amino]-7-phenylthieno[2,3-b]pyridin-6(7H)-one

N-((3R)-1-{[3,4-bis(methyloxy)phenyl]sulfonyl}-3-pyrrolidinyl)-3,4-bis(methyloxy)benzenesulfonamide

Refernces

• 1、 Cesare, P. Di,Bouzard, D.,Essiz, M.,Jacquet, J. P.,Ledoussal, B.,et al.. "Fluoronaphthyridines and -quinolines as Antibacterial Agents. 5. Synthesis and Antimicrobial Activity of Chiral 1-tert-Butyl-6-fluoro-7-substituted-naphthyridones". . p. 4205 - 4213. Retrieved 2007/10/02.