3-Pyridinepropanamine dihydrochloride

Base Information

• Chemical Name: 3-Pyridinepropanamine dihydrochloride
• CAS No.: 115816-04-1
• Molecular Formula: C₈H₁₂N₂*2ClH
• Molecular Weight: 209.119
• DSSTox Substance ID: DTXSID20602904
• Mol file: 115816-04-1.mol

Synonyms:3-Pyridinepropanamine dihydrochloride;115816-04-1;3-pyridin-3-ylpropan-1-amine;dihydrochloride;3-(pyridin-3-yl)propan-1-amine dihydrochloride;4-Pyridinepropanamine dihydrochloride;SCHEMBL10678754;DTXSID20602904;HTOCHLUQYMLNJU-UHFFFAOYSA-N;XLB18908;3-(3-pyridinyl)propylamine dihydrochloride;DB-081480;G22465;EN300-1663198;Z3058301115;3-(Pyridin-3-yl)propan-1-amine--hydrogen chloride (1/2)

Chemical Property of 3-Pyridinepropanamine dihydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 208.0534038
• Heavy Atom Count: 12
• Complexity: 83.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CN=C1)CCCN.Cl.Cl

Technology Process of 3-Pyridinepropanamine dihydrochloride

There total 3 articles about 3-Pyridinepropanamine 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: 93.0%

→ 3-(3-pyridyl)propan-1-amine dihydrochloride (115816-04-1)

Guidance literature:

With hydrazine hydrate; In ethanol; for 3h; Reflux;

With hydrogenchloride; In ethanol; water;

Reference yield:

3-(3-azidopropyl)pyridine → 3-(3-pyridyl)propan-1-amine dihydrochloride (115816-04-1)

Guidance literature:

3-(3-azidopropyl)pyridine; With triethyl phosphite; In benzene; Reflux;

With hydrogenchloride; In methanol; at 20 ℃;

DOI:10.1021/acs.jmedchem.7b00835

Reference yield:

3-(3-pyridyl)propan-1-ol (2859-67-8) → 3-(3-pyridyl)propan-1-amine dihydrochloride (115816-04-1)

Guidance literature:

Multi-step reaction with 2 steps

1.1: triphenylphosphine; diphenylphosphoranyl azide; di-isopropyl azodicarboxylate / tetrahydrofuran / 0 - 20 °C

2.1: triethyl phosphite / benzene / Reflux

2.2: 20 °C

With di-isopropyl azodicarboxylate; diphenylphosphoranyl azide; triphenylphosphine; triethyl phosphite; In tetrahydrofuran; benzene; 1.1: |Mitsunobu Displacement / 2.1: |Staudinger Azide Reduction;

DOI:10.1021/acs.jmedchem.7b00835

upstream raw materials:

3-(3-pyridyl)propan-1-ol

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