1H-Imidazole-2-carboxylic acid, 4,5-dichloro-

Base Information

• Chemical Name: 1H-Imidazole-2-carboxylic acid, 4,5-dichloro-
• CAS No.: 64736-53-4
• Molecular Formula: C4H2Cl2N2O2
• Molecular Weight: 180.97700
• DSSTox Substance ID: DTXSID60450406
• Wikidata: Q82270113
• Mol file: 64736-53-4.mol

Synonyms:4,5-dichloro-1H-imidazole-2-carboxylic Acid;64736-53-4;1H-Imidazole-2-carboxylic acid, 4,5-dichloro-;4,5-dichloroimidazole-2-carboxylic acid;SCHEMBL2824127;DTXSID60450406;IXMKNMGPLCJFEC-UHFFFAOYSA-N;AKOS006371728;BS-52452;4,5-dichloro-1H-imidazole-2-carboxylicAcid;CS-0186909

Chemical Property of 1H-Imidazole-2-carboxylic acid, 4,5-dichloro-

Chemical Property:

• Melting Point: 159-160 °C (decomp)
• Boiling Point: 463.0±48.0 °C(Predicted)
• PSA: 65.98000
• Density: 1.857±0.06 g/cm3(Predicted)
• LogP: 1.41470
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 179.9493327
• Heavy Atom Count: 10
• Complexity: 154

Purity/Quality:

97% ^*data from raw suppliers

4,5-Dichloro-1h-imidazole-2-carboxylicacid 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=C(N=C(N1)C(=O)O)Cl)Cl

Technology Process of 1H-Imidazole-2-carboxylic acid, 4,5-dichloro-

There total 6 articles about 1H-Imidazole-2-carboxylic acid, 4,5-dichloro- 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: 91.0%

2,3,7,8-tetrachloro-5H,10H-diimidazo<1,2-a:1',2'-d>pyrazine-5,10-dione (64738-53-0) → 4,5-dichloro-imidazole-2-carboxylic acid (64736-53-4)

Guidance literature:

With water; base; Heating;

Reference yield: 76.0%

→ 4,5-dichloro-imidazole-2-carboxylic acid (64736-53-4)

Guidance literature:

Reference yield: 52.0%

1H-imidazole-2-carboxylic acid (16042-25-4) → 4,5-dichloro-imidazole-2-carboxylic acid (64736-53-4)

Guidance literature:

With hydrogenchloride; sodium hydroxide; sodium hypochlorite;

upstream raw materials:

1H-imidazole-2-carboxylic acid

carbon dioxide

2,4,5-trichloro-1H-imidazole

2-bromo-4,5-dichloro-1 H-imidazole

Downstream raw materials:

4,5-dichloroimidazole