1-(3-chloropropyl)pyrrolidine Hydrochloride

Base Information

• Chemical Name: 1-(3-chloropropyl)pyrrolidine Hydrochloride
• CAS No.: 57616-69-0
• Molecular Formula: C7H15Cl2N
• Molecular Weight: 184.109
• Hs Code.: 2933990090
• European Community (EC) Number: 641-357-8
• ChEMBL ID: CHEMBL4550706
• DSSTox Substance ID: DTXSID60468748
• Mol file: 57616-69-0.mol

Synonyms:57616-69-0;1-(3-chloropropyl)pyrrolidine Hydrochloride;N-(3-Chloropropyl)pyrrolidine Hydrochloride;(3-CHLOROPROPYL)PYRROLIDINE HYDROCHLORIDE;(3-Chloropropyl)pyrrolidine HCl;1-(3-chloropropyl)pyrrolidine;hydrochloride;(3-Chloropropyl)pyrrolidine, HCl;N-(3-Chloropropyl)pyrrolidine HCl;MFCD07787233;Pyrrolidine, 1-(3-chloropropyl)-, hydrochloride;SCHEMBL737731;CHEMBL4550706;DTXSID60468748;UUPCYQIIQHSPKR-UHFFFAOYSA-N;AKOS015846040;AC-1384;SB12112;AM804073;AS-17980;SY003325;1-(3-chloropropyl)pyrrolidineHydrochloride;1-(3-chloropropyl)pyrrolidine, hydrochloride;CS-0054075;FT-0679296;EN300-54467;3-(pyrrolidin-1-yl)propyl chloride hydrochloride;A869632

Chemical Property of 1-(3-chloropropyl)pyrrolidine Hydrochloride

Chemical Property:

• Vapor Pressure: 0.44mmHg at 25°C
• Melting Point: 134-136 °C
• Boiling Point: 194.5 °C at 760 mmHg
• Flash Point: 71.4 °C
• PSA: 3.24000
• LogP: 2.45100
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 183.0581549
• Heavy Atom Count: 10
• Complexity: 69.3

Purity/Quality:

98%,99%, ^*data from raw suppliers

(3-Chloropropyl)pyrrolidineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)CCCCl.Cl

Technology Process of 1-(3-chloropropyl)pyrrolidine Hydrochloride

There total 2 articles about 1-(3-chloropropyl)pyrrolidine Hydrochloride 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-(3-chloropropyl)pyrrolidine (39743-20-9) → 1-(3-chloropropyl)pyrrolidine hydrochloride (57616-69-0)

Guidance literature:

With hydrogenchloride; In water; toluene; pH=0.5 - 1.0; Industry scale;

Reference yield:

3-pyrrolidin-1-yl-propan-1-ol (19748-66-4) → 1-(3-chloropropyl)pyrrolidine hydrochloride (57616-69-0)

Guidance literature:

With thionyl chloride; In dichloromethane; for 2.5h; cooling;

DOI:10.1039/b600567e

Reference yield: 98.0%

5-bromo-2-(trifluoromethoxy)phenol (1048963-39-8) + 1-(3-chloropropyl)pyrrolidine hydrochloride (57616-69-0) → 1-[3-[5-bromo-2-(trifluoromethoxy)phenoxy]propyl]pyrrolidine

Guidance literature:

With caesium carbonate; sodium iodide; In N,N-dimethyl-formamide; at 90 ℃; for 2h;

upstream raw materials:

3-pyrrolidin-1-yl-propan-1-ol

1-(3-chloropropyl)pyrrolidine

Downstream raw materials:

3,4,5-trimethoxy-benzoic acid-(3-pyrrolidino-propyl ester)

4-(3'-pyrrolidin-1''-ylpropoxy)benzaldehyde

N-[3-(4-methoxymethoxy-phenyl)-1-methyl-propyl]-2-[2-phenyl-6-(3-pyrrolidin-1-yl-propoxy)-1H-indol-3-yl]-acetamide

2-[3-(1-pyrrolidinyl)propylthio]-5-(2-chlorophenyl)-7-chloro-3H-1,4-benzodiazepine fumarate

Refernces

• 1、 Le Sann, Christine,Baron, Anne,Mann, John,Van Den Berg, Hendrik,Gunaratnam, Mekala,Neidle, Stephen. "New mustard-linked 2-aryl-bis-benzimidazoles with anti-proliferative activity". . p. 1305 - 1312. Retrieved 2007/10/03.