1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride

Base Information

• Chemical Name: 1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride
• CAS No.: 103124-99-8
• Molecular Formula: C₁₀H₁₁N₃O₂*ClH
• Molecular Weight: 241.677
• DSSTox Substance ID: DTXSID80145660
• ChEMBL ID: CHEMBL555383

Synonyms:103124-99-8;1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride;K-3827;2-Imidazoline, 2-(3,4-(methylenedioxy)anilino)-, monohydrochloride;4,5-Dihydro-N-1,3-benzodioxol-5-yl-1H-imidazol-2-amine hydrochloride;1H-Imidazole, 4,5-dihydro-2-((1,3-benzodioxol-5-yl)amino)-, monohydrochloride;CHEMBL555383;DTXSID80145660;N-(1,3-benzodioxol-5-yl)-4,5-dihydro-1H-imidazol-2-amine hydrochloride;LS-77932

Chemical Property of 1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride

Chemical Property:

• Vapor Pressure: 0.000229mmHg at 25°C
• Boiling Point: 325.5°Cat760mmHg
• Flash Point: 150.7°C
• PSA: 54.88000
• Density: g/cm³
• LogP: 1.42580
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 241.0618043
• Heavy Atom Count: 16
• Complexity: 269

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN=C(N1)NC2=CC3=C(C=C2)OCO3.Cl

Technology Process of 1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride

There total 1 articles about 1H-Imidazol-2-amine, 4,5-dihydro-N-1,3-benzodioxol-5-yl-, monohydrochloride 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: 95.0%

1-[1,3-di(tert-butoxycarbonyl)-2-imidazolidinylimino]-3,4-(methylenedioxy)benzene → 5-(2-imidazolin-2-ylamino)-1,3-benzodioxole hydrochloride (103124-99-8)

Guidance literature:

1-[1,3-di(tert-butoxycarbonyl)-2-imidazolidinylimino]-3,4-(methylenedioxy)benzene; With trifluoroacetic acid; In dichloromethane; for 3h;

In water; for 24h; Further stages.;

DOI:10.1021/jm070229q

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