3-(1H-Imidazol-2-YL)propan-1-amine

Base Information

• Chemical Name: 3-(1H-Imidazol-2-YL)propan-1-amine
• CAS No.: 41306-56-3
• Molecular Formula: C6H11N3
• Molecular Weight: 125.173
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID60535020
• Wikidata: Q82409097
• Mol file: 41306-56-3.mol

Synonyms:3-(1H-IMIDAZOL-2-YL)PROPAN-1-AMINE;41306-56-3;3-(1H-IMIDAZOL-2-YL)-1-PROPANAMINE;1H-IMIDAZOLE-2-PROPANAMINE;aminopropylimidazole;1H-imidazole-propanamine;2-(3-aminopropyl)imidazole;SCHEMBL72312;DTXSID60535020;HQNOODJDSFSURF-UHFFFAOYSA-N;MFCD09912898;AKOS015997898;AB55095;CS-0356221;EN300-141392;F10426;ZQG

Chemical Property of 3-(1H-Imidazol-2-YL)propan-1-amine

Chemical Property:

• PSA: 54.70000
• LogP: 1.00130
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 125.095297364
• Heavy Atom Count: 9
• Complexity: 74.7

Purity/Quality:

98%min ^*data from raw suppliers

[3-(1H-Imidazol-2-yl)propyl]amine dihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CN=C(N1)CCCN

Technology Process of 3-(1H-Imidazol-2-YL)propan-1-amine

There total 2 articles about 3-(1H-Imidazol-2-YL)propan-1-amine 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:

2-[3-(1-tosyl-1H-imidazol-2-yl)propyl]isoindoline-1,3-dione (1207430-17-8) → 3-(2-imidazolyl)propylamine (41306-56-3)

Guidance literature:

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

Reference yield:

→ 3-(2-imidazolyl)propylamine (41306-56-3)

Guidance literature:

Reference yield: 78.0%

(E)-2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-acrylic acid methyl ester (87101-68-6) + 3-(2-imidazolyl)propylamine (41306-56-3) → (E)-N-(3-(1H-imidazol-1-yl)propyl)-2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)acrylamide

Guidance literature:

(E)-2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-acrylic acid methyl ester; With potassium hydroxide; In methanol; water; at 50 ℃; for 4h;

With 1,1'-carbonyldiimidazole; In acetonitrile; at 50 ℃; for 1h;

3-(2-imidazolyl)propylamine; In acetonitrile; at 50 ℃; for 2h;

DOI:10.1016/j.ejmech.2019.01.056

upstream raw materials:

2-[3-(1-tosyl-1H-imidazol-2-yl)propyl]isoindoline-1,3-dione

Downstream raw materials:

2-Amino-N-[3-(1H-imidazole-1-yl)propyl]benzamide

N-(3-(1H-imidazol-1-yl)propyl)-1-(2,4-dichlorobenzyl)-1H-indazole-3-carboxamide

(4R)-N-(3-(3-(1H-imidazol-1-yl)propylamino)-3-oxopropyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane-4-carboxamide

Refernces

• 1、 -. "Oligomeric aminodiol-containing compounds, libraries thereof, and process of preparing the same". . . Retrieved 2008/06/13.