(1H-Imidazol-4-yl)methanamine dihydrochloride

Base Information

• Chemical Name: (1H-Imidazol-4-yl)methanamine dihydrochloride
• CAS No.: 72631-80-2
• Molecular Formula: C₄H₇N₃*2ClH
• Molecular Weight: 170.042
• Hs Code.: 2933290090
• European Community (EC) Number: 853-763-4
• DSSTox Substance ID: DTXSID40496862
• Mol file: 72631-80-2.mol

Synonyms:72631-80-2;(1H-Imidazol-4-yl)methanamine dihydrochloride;1H-IMIDAZOL-4-YLMETHYLAMINE DIHYDROCHLORIDE;(1H-imidazol-5-yl)methanamine dihydrochloride;4-(Aminomethyl)imidazole dihydrochloride;1H-imidazol-5-ylmethanamine;dihydrochloride;imidazole-4-methanamine dihydrochloride;MFCD09056757;SCHEMBL1308551;SCHEMBL18226068;AMY7828;DTXSID40496862;1h-imidazol-4-ylmethanamine 2hcl;SHZKSYVHYHSHGU-UHFFFAOYSA-N;C-(1H-IMIDAZOL-4(5)-YL)-METHYLAMINE DIHYDROCHLORIDE;(1H-Imidazol-4-yl)methanamine 2HCl;AKOS015845549;AKOS016034921;CS-W020523;MB06927;AS-39552;SY018114;(1H-Imidazol-4-yl)methanaminedihydrochloride;FT-0678428;4-(amino-methyl)-1H-imidazole dihydrochloride;5-(Aminomethyl)-1H-imidazole dihydrochloride;EN300-82476;C-(1H-imidazol-4-yl)methylamine dihydrochloride;A854087;C-(1H-Imidazol-4-yl)-methylamine dihydrochloride;1-(1H-IMIDAZOL-4-YL)METHANAMINE DIHYDROCHLORIDE;Z1250100778;1-(1H-Imidazol-5-yl)methanamine--hydrogen chloride (1/2)

Chemical Property of (1H-Imidazol-4-yl)methanamine dihydrochloride

Chemical Property:

• Melting Point: 246-247 °C
• PSA: 54.70000
• LogP: 2.17270
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 169.0173527
• Heavy Atom Count: 9
• Complexity: 54.9

Purity/Quality:

97% ^*data from raw suppliers

(1H-Imidazol-4-yl)methanaminedihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(NC=N1)CN.Cl.Cl

Technology Process of (1H-Imidazol-4-yl)methanamine dihydrochloride

There total 4 articles about (1H-Imidazol-4-yl)methanamine 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: 100.0%

4(5)formylimidazole (3034-50-2) → imidazole-4-methanamine dihydrochloride (66247-84-5,72631-80-2)

Guidance literature:

4⁽⁵⁾formylimidazole; With ammonia; Raney nickel; In methanol; at 40 ℃; for 0.5h;

With hydrogen; In methanol; at 40 - 50 ℃; for 28h; under 3750.38 Torr;

With hydrogenchloride; In methanol; diethyl ether;

Reference yield: 94.0%

4-azidomethyl-1H-1-triphenylmethylimidazole (191104-34-4) → imidazole-4-methanamine dihydrochloride (66247-84-5,72631-80-2)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In methanol; under 49400 Torr;

Reference yield: 29.0%

piperidin-1-yl-(1-trityl-1H-imidazol-4-yl-methylene)amine (1225653-08-6) → imidazole-4-methanamine dihydrochloride (66247-84-5,72631-80-2)

Guidance literature:

With hydrogenchloride; hydrogen; palladium 10% on activated carbon; In tetrahydrofuran; ethanol; ethyl acetate; at 80 ℃; for 3h; under 4500.45 Torr;

upstream raw materials:

1(H)-imidazole-4⁽⁵⁾-carbaldehyde oxime

4-azidomethyl-1H-1-triphenylmethylimidazole

4⁽⁵⁾formylimidazole

piperidin-1-yl-(1-trityl-1H-imidazol-4-yl-methylene)amine

Downstream raw materials:

N₆-benzoyl-5'-O-(4,4'-dimethoxytrityl)-8-[(4-imidazolyl)methylamino]-2'-deoxyadenosine

methyl (S)-2-[3-(1H-imidazol-4-yl-methyl)ureido]-3-(4-methoxyphenyl)-propanoate