Pentan-3-amine hydrochloride

Base Information

• Chemical Name: Pentan-3-amine hydrochloride
• CAS No.: 5398-26-5
• Molecular Formula: C5H13N
• Molecular Weight: 123.626
• DSSTox Substance ID: DTXSID80585820
• NSC Number: 4605
• Mol file: 5398-26-5.mol

Synonyms:Pentan-3-amine hydrochloride;5398-26-5;Pentan-3-aminhydrochlorid;pentan-3-amine;hydrochloride;DTXSID80585820;NSC4605;NSC-4605;AKOS025116604;Pentan-3-amine--hydrogen chloride (1/1)

Chemical Property of Pentan-3-amine hydrochloride

Chemical Property:

• Boiling Point: 92.1°Cat760mmHg
• Flash Point: 2.2°C
• Density: 0.757g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 123.0814771
• Heavy Atom Count: 7
• Complexity: 23.1

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)N.Cl

Technology Process of Pentan-3-amine hydrochloride

There total 1 articles about Pentan-3-amine 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:

pentane (109-66-0,8031-35-4,9078-70-0) → 1-methyl-butylamine hydrochloride (76716-21-7,101689-05-8,216237-52-4) + pentan-3-amine hydrochloride (5398-26-5) + n-pentylamine hydrochloride (142-65-4)

Guidance literature:

pentane; With cerium(III) chloride; 1,1,1-trichloroethanol; di-tert-butyl-diazodicarboxylate; tetrabutyl-ammonium chloride; In acetonitrile; at 20 ℃; for 12h; Irradiation; Inert atmosphere; Sealed tube;

With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 1h; Reagent/catalyst; Further stages;

DOI:10.1021/jacs.0c00212

Reference yield:

pentan-3-amine hydrochloride (5398-26-5) → 3-aminopentane (616-24-0)

Guidance literature:

With potassium hydroxide; Yield given;

Reference yield:

N-cyano-N'-(2,4-dichloro-phenyl)-guanidine (855889-97-3) + pentan-3-amine hydrochloride (5398-26-5) → 1-(1-ethyl-propyl)-5-(2,4-dichloro-phenyl)-biguanide

Guidance literature:

at 180 ℃;

upstream raw materials:

pentane

Downstream raw materials:

3-aminopentane

Refernces