1-(2-chloroethyl)-1H-imidazole hydrochloride

Base Information

• Chemical Name: 1-(2-chloroethyl)-1H-imidazole hydrochloride
• CAS No.: 18994-78-0
• Molecular Formula: C5H7 Cl N2 . Cl H
• Molecular Weight: 167.038
• Hs Code.: 2933290090
• European Community (EC) Number: 670-669-7
• DSSTox Substance ID: DTXSID20373925
• Mol file: 18994-78-0.mol

Synonyms:1-(2-chloroethyl)-1H-imidazole hydrochloride;18994-78-0;1-(2-chloroethyl)imidazole Hydrochloride;N-(2-Chloroethyl)-imidazole hydrochloride;1-(2-chloroethyl)imidazole;hydrochloride;1H-Imidazole, 1-(2-chloroethyl)-, hydrochloride (1:1);SCHEMBL8241;1H-Imidazole, 1-(2-chloroethyl)-, monohydrochloride;DTXSID20373925;LXILQBZVZYRMND-UHFFFAOYSA-N;MFCD00799332;1-(2-Chloroethyl)-1H-imidazole HCl;AKOS008048977;CS-W021201;n-(2-chloroethyl)imidazole hydrochloride;DS-17197;1-(2-chloroethyl)-imidazole hydrochloride;1-(2-chloroethyl)-1H-imidazole hydrochlorid;EN300-13783;1-(2-Chloro-ethyl)-1H-imidazole hydrochloride;D78072;N-(2-CHLOROETHYL)-IMIDAZOLEHYDROCHLORIDE;A880436;J-012261;Z94599643

Chemical Property of 1-(2-chloroethyl)-1H-imidazole hydrochloride

Chemical Property:

• Vapor Pressure: 0.0117mmHg at 25°C
• Melting Point: 108 °C
• Boiling Point: 269.9°C at 760 mmHg
• Flash Point: 117°C
• PSA: 17.82000
• LogP: 1.92390
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 166.0064537
• Heavy Atom Count: 9
• Complexity: 67.4

Purity/Quality:

98% ^*data from raw suppliers

1-(2-Chloroethyl)-1H-imidazoleHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(C=N1)CCCl.Cl
• Uses: 1-(2-Chloroethyl)imidazole Hydrochloride is used in the preparation of preparation of substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors.

Technology Process of 1-(2-chloroethyl)-1H-imidazole hydrochloride

There total 1 articles about 1-(2-chloroethyl)-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: 100.0%

1-(2-Hydroxyethyl)imidazole (1615-14-1) → 1-(2-chloroethyl)-1H-imidazole hydrochloride (18994-78-0)

Guidance literature:

With thionyl chloride;

DOI:10.1007/s11172-009-0118-z

Reference yield: 94.0%

1-(2-chloroethyl)-1H-imidazole hydrochloride (18994-78-0) + phenylmethanethiol (100-53-8) → 1-(benzylsulfanyl)-2-(1H-imidazol-1-yl)ethane (1353585-76-8)

Guidance literature:

phenylmethanethiol; With sodium ethanolate; In ethanol; for 0.5h; Reflux; Inert atmosphere;

1-(2-chloroethyl)-1H-imidazole hydrochloride; In ethanol; at 20 ℃; for 20h; Reflux; Inert atmosphere;

DOI:10.1002/cmdc.201100602

Reference yield: 72.0%

1-(2-chloroethyl)-1H-imidazole hydrochloride (18994-78-0) + methyl 4-[N-(1-oxopropyl)-N-phenylamino]-4-piperidinecarboxylate (72996-78-2) → N-(phenyl)-N-[1-(2-(1H-imidazol-1-yl)ethyl)-4-methoxycarbonyl-4-piperidinyl]propanamide (131727-30-5)

Guidance literature:

With sodium carbonate; sodium iodide; In acetonitrile; Heating;

DOI:10.1021/jm00106a051

upstream raw materials:

1-(2-Hydroxyethyl)imidazole

Downstream raw materials:

N-(phenyl)-N-[1-(2-(1H-imidazol-1-yl)ethyl)-4-methoxycarbonyl-4-piperidinyl]propanamide

C₂₁H₂₉N₃O₃

2-(3-(2-(1H-imidazol-1-yl)ethoxy)-5-(2-fluorobenzyloxy)phenyl)-6-bromo-4H-imidazo[4,5-b]pyridine

1-{3-[2-(1H-imidazol-1-yl)ethoxy]phenyl}-3-(morpholin-4-ylcarbonyl)-1,4-dihydrothiochromeno[4,3-c]pyrazole 5,5-dioxide

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