2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride

Base Information

• Chemical Name: 2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride
• CAS No.: 13338-49-3
• Molecular Formula: C4H7ClN2^.HCl
• Molecular Weight: 155.027
• Hs Code.: 2933290090
• European Community (EC) Number: 641-883-8
• NSC Number: 187479
• DSSTox Substance ID: DTXSID50375417
• Wikidata: Q27124097
• Metabolomics Workbench ID: 58651
• Mol file: 13338-49-3.mol

Synonyms:2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride;13338-49-3;2-(chloromethyl)-4,5-dihydro-1H-imidazole;hydrochloride;MFCD04115823;1H-Imidazole, 2-(chloromethyl)-4,5-dihydro-, monohydrochloride;chlormethylimidazoline hydrochloride;2-(Chloromethyl)-4,5-dihydro-1h-imidazole, HCl;2-chloromethyl-4,5-dihydro-1h-imidazole hydrochloride;2-(chloromethyl)imidazoline hydrochloride;2-chloromethyl-2-imidazoline hydrochloride;2-(chloromethyl)-4,5-dihydro-1h-imidazolehydrochloride;C4H8Cl2N2;NSC187479;2-(CHLOROMETHYL)-4,5-DIHYDRO-1H-IMIDAZOLE HCL;2-(Chloromethyl)-4,5-dihydro-1H-imidazole monohydrochloride;2-(Chloromethyl)-4,5-dihydroimidazole Hydrochloride;AMY745;SCHEMBL4106276;CHEBI:53553;DTXSID50375417;GHCCHMFFNHOXEU-UHFFFAOYSA-N;1h-imidazole, 2-(chloromethyl)-4,5-dihydro-monohydrochloride;1H-Imidazole, 2-(chloromethyl)-4,5-dihydro-, hydrochloride (1:1);2-chloromethylimidazoline-hydrochloride;AKOS005254322;AKOS028109510;AC-7479;CS-W021432;LM-0056;NSC-187479;SY046532;FT-0656355;EN300-35346;A806608;J-006364;Q27124097;2-(chloromethyl) -4,5-dihydro-1H-imidazole hydrochloride

Chemical Property of 2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride

Chemical Property:

• Melting Point: 195-197 °C
• Boiling Point: 258.4oC at 760mmHg
• Flash Point: 110.1oC
• PSA: 24.39000
• LogP: 0.79330
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 154.0064537
• Heavy Atom Count: 8
• Complexity: 89.7

Purity/Quality:

99% ^*data from raw suppliers

2-(Chloromethyl)-4,5-dihydro-1H-imidazoleHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN=C(N1)CCl.Cl
• Uses: 2-(Chloromethyl)-4,5-dihydro-1H-imidazole hydrochloride is used in preparation of disubstituted 1,2,4-triazines and their use for pharmaceutical compound and prevention/treatment of diseases or symptoms involving aldosterone.

Technology Process of 2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride

There total 1 articles about 2-(chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride 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-(chloromethyl)-2-imidazoline hydrochloride (13338-49-3)

Guidance literature:

Reference yield: 81.0%

2-(chloromethyl)-2-imidazoline hydrochloride (13338-49-3) + o-chloroaniline (95-51-2) → 2-chloro-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-aniline; hydrochloride (67084-31-5)

Guidance literature:

In ethanol; for 24h; Heating;

DOI:10.1021/jm00366a022

Reference yield: 77.0%

2-(chloromethyl)-2-imidazoline hydrochloride (13338-49-3) + 2,3-Dimethylaniline (87-59-2) → 2-(2',3'-Dimethylphenylaminomethyl)-2-imidazoline hydrochloride

Guidance literature:

In ethanol;

Downstream raw materials:

2-(2,5-dimethyl-phenoxymethyl)-4,5-dihydro-1H-imidazole; hydrochloride

1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-phenyl-indole

1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-phenyl-2,3-dihydro-indole

Phenoxazoline hydrochloride

Refernces