2-[3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-2-nitro-2H-imidazol-1-y l]acetamide

Base Information

• Chemical Name: 2-[3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-2-nitro-2H-imidazol-1-y l]acetamide
• CAS No.: 154094-89-0
• Molecular Formula: C₁₁H₁₃N₇O₅
• Molecular Weight: 323.268
• Mol file: 154094-89-0.mol

Synonyms:NSC 644497

Chemical Property of 2-[3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-2-nitro-2H-imidazol-1-y l]acetamide

Chemical Property:

• Vapor Pressure: 2.15E-18mmHg at 25°C
• Boiling Point: 680.9°Cat760mmHg
• Flash Point: 365.6°C
• PSA: 160.02000
• Density: 1.67g/cm³
• LogP: 1.30600

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-[3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-2-nitro-2H-imidazol-1-y l]acetamide

There total 5 articles about 2-[3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-2-nitro-2H-imidazol-1-y l]acetamide 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: 35.0%

2-(2-methyl-5-nitro-imidazol-3-ium-1-yl)ethylammonium dichloride (49575-10-2) + 2-(2-nitro-1H-imidazol-1-yl)acetic acid (22813-32-7) → N-[2-(2-methyl-5-nitro-1H-imidazolyl)ethyl]-2-(2-nitro-1H-imidazolyl)ethanamide (154094-89-0)

Guidance literature:

With diethyl cyanophosphonate; triethylamine; In N,N-dimethyl-formamide; 1.) 0 deg C, 2h, 2.) 20 deg C, 18 h;

Reference yield:

[2-(2-methyl-5-nitro-1H-imidazol-1-yl)]ethylazide (60666-28-6) → N-[2-(2-methyl-5-nitro-1H-imidazolyl)ethyl]-2-(2-nitro-1H-imidazolyl)ethanamide (154094-89-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 1.) Ph₃P, 2.) conc. aq. HCl / 1.) THF, 20 deg C, 3 h, 2>) THF, reflux, 5 h

2: 35 percent / Et₃N, diethylphosphorocyanidate / dimethylformamide / 1.) 0 deg C, 2h, 2.) 20 deg C, 18 h

With hydrogenchloride; diethyl cyanophosphonate; triethylamine; triphenylphosphine; In N,N-dimethyl-formamide;

Reference yield:

2-(5-nitro-2-methyl-1-imidazolyl)ethyl methanesulfonate (30746-54-4) → N-[2-(2-methyl-5-nitro-1H-imidazolyl)ethyl]-2-(2-nitro-1H-imidazolyl)ethanamide (154094-89-0)

Guidance literature:

Multi-step reaction with 3 steps

1: NaN₃ / dimethylformamide / 1 h / 100 °C

2: 1.) Ph₃P, 2.) conc. aq. HCl / 1.) THF, 20 deg C, 3 h, 2>) THF, reflux, 5 h

3: 35 percent / Et₃N, diethylphosphorocyanidate / dimethylformamide / 1.) 0 deg C, 2h, 2.) 20 deg C, 18 h

With hydrogenchloride; sodium azide; diethyl cyanophosphonate; triethylamine; triphenylphosphine; In N,N-dimethyl-formamide;

upstream raw materials:

2-(2-methyl-5-nitro-imidazol-3-ium-1-yl)ethylammonium dichloride

2-(2-nitro-1H-imidazol-1-yl)acetic acid

[2-(2-methyl-5-nitro-1H-imidazol-1-yl)]ethylazide

2-(5-nitro-2-methyl-1-imidazolyl)ethyl methanesulfonate

Refernces