5-Methyl-4,5-dihydro-1H-imidazole

Base Information

• Chemical Name: 5-Methyl-4,5-dihydro-1H-imidazole
• CAS No.: 1615-03-8
• Molecular Formula: C4H8N2
• Molecular Weight: 84.1209
• European Community (EC) Number: 856-865-7
• DSSTox Substance ID: DTXSID30495788
• Nikkaji Number: J2.098.937H
• Mol file: 1615-03-8.mol

Synonyms:1615-03-8;5-Methyl-4,5-dihydro-1H-imidazole;1H-Imidazole, 4,5-dihydro-4-methyl-;4-methylimidazolin;DTXSID30495788;4-methyl-4,5-dihydro-1h-imidazole;AKOS006379737;EN300-6956484

Chemical Property of 5-Methyl-4,5-dihydro-1H-imidazole

Chemical Property:

• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 84.068748264
• Heavy Atom Count: 6
• Complexity: 67.9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN=CN1

Technology Process of 5-Methyl-4,5-dihydro-1H-imidazole

There total 3 articles about 5-Methyl-4,5-dihydro-1H-imidazole 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:

carbon monoxide (201230-82-2) + 1,2-diaminopropan (78-90-0,10424-38-1) → 4-methyl-imidazolidin-2-one (6531-31-3) + (2-amino-propyl)-carbamic acid (78288-95-6) + (β-amino-isopropyl)-carbamic acid (78288-96-7) + 5-methyl-4,5-dihydro-1H-imidazole (1615-03-8)

Guidance literature:

With tetracarbonyl nickel; In ethanol; at 160 ℃; for 18h; Title compound not separated from byproducts;

DOI:10.1016/S0022-328X(00)83034-X

Reference yield:

carbon monoxide (201230-82-2) + 1,2-diaminopropan (78-90-0,10424-38-1) → 4-methyl-imidazolidin-2-one (6531-31-3) + 4-methylimidazoline (1615-03-8) + (β-amino-isopropyl)-carbamic acid (78288-96-7) + 5-methyl-4,5-dihydro-1H-imidazole (1615-03-8)

Guidance literature:

With tetracarbonyl nickel; In ethanol; at 160 ℃; for 18h; Further byproducts given. Title compound not separated from byproducts;

DOI:10.1016/S0022-328X(00)83034-X

Reference yield:

carbon monoxide (201230-82-2) + 1,2-diaminopropan (78-90-0,10424-38-1) → 4-methyl-imidazolidin-2-one (6531-31-3) + 4-methylimidazoline (1615-03-8) + (β-amino-isopropyl)-carbamic acid (78288-96-7) + 5-methyl-4,5-dihydro-1H-imidazole (1615-03-8)

Guidance literature:

With tetracarbonyl nickel; In ethanol; at 160 ℃; for 18h; Further byproducts given. Title compound not separated from byproducts;

DOI:10.1016/S0022-328X(00)83034-X

upstream raw materials:

carbon monoxide

1,2-diaminopropan

Downstream raw materials:

1-tosyl-4-methylimidazoline

1-(3-nitrobenzenesulfonyl)-4-methylimidazoline

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