2-Methyl-1H-imidazol-1-amine

Base Information

• Chemical Name: 2-Methyl-1H-imidazol-1-amine
• CAS No.: 51741-29-8
• Molecular Formula: C3H5N3
• Molecular Weight: 83.0928
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID40601752
• Wikidata: Q82498562
• Mol file: 51741-29-8.mol

Synonyms:2-METHYL-1H-IMIDAZOL-1-AMINE;2-methylimidazol-1-amine;C4H7N3;DTXSID40601752;AKOS006340954;AB44383;A18828

Chemical Property of 2-Methyl-1H-imidazol-1-amine

Chemical Property:

• Boiling Point: 243.8±23.0 °C(Predicted)
• PKA: 6.40±0.10(Predicted)
• PSA: 43.84000
• Density: 1.29±0.1 g/cm3(Predicted)
• LogP: 0.17810
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 97.063997236
• Heavy Atom Count: 7
• Complexity: 64

Purity/Quality:

99% ^*data from raw suppliers

1H-Imidazol-1-amine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=CN1N
• Use Description: 2-Methyl-1H-imidazol-1-amine, a chemical compound, has versatile applications across various fields. In the pharmaceutical industry, it serves as a valuable intermediate in the synthesis of pharmaceutical compounds, playing a pivotal role in drug development and manufacturing processes. Its structural properties make it essential for creating a wide range of drug candidates. In the field of organic chemistry, it is utilized as a building block for the synthesis of complex organic molecules, aiding researchers in the development of new materials, catalysts, and specialty chemicals. Additionally, in academic research, 2-Methyl-1H-imidazol-1-amine is used as a reference material and substrate for investigating reaction mechanisms, enabling advancements in synthetic chemistry and chemical research. Its versatility as a chemical intermediate underscores its significance in pharmaceuticals, chemical research, and academia, contributing to progress and innovation in these diverse fields.

Technology Process of 2-Methyl-1H-imidazol-1-amine

There total 3 articles about 2-Methyl-1H-imidazol-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: 21.0%

1H-imidazole (288-32-4) → amino-imidazole (51741-29-8)

Guidance literature:

With potassium hydroxide; hydroxylamine-O-sulfonic acid; In water; at 80 ℃; for 1h; Inert atmosphere;

DOI:10.1021/om500554t

Reference yield:

1-amino-3-methoxymethylimidazolium picrate → amino-imidazole (51741-29-8)

Guidance literature:

With hydrogenchloride; for 30h; Heating;

DOI:10.1007/BF01184881

Reference yield:

→ amino-imidazole (51741-29-8)

Guidance literature:

Imidazol, KOH, Hydroxylamin-O-sulfonylsaeure;

upstream raw materials:

1H-imidazole

Downstream raw materials:

1-(benzylideneamino)imidazole

Imidazol-1-yl-[1-(5-nitro-thiophen-2-yl)-meth-(E)-ylidene]-amine

Refernces

• 1、 -. "Bicyclic aminoimidazoles". . . Retrieved 2008/06/13.
• 2、 -. "Method for inhibiting advanced glycosylation of proteins using aminosubstituted imidazoles". . . Retrieved 2008/06/13.