2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid

Base Information

Chemical Name:2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid
CAS No.:69570-99-6
Molecular Formula:C14H9 N3 O4
Molecular Weight:283.243
Hs Code.:2933990090
DSSTox Substance ID:DTXSID30442550
Wikidata:Q82259881
Mol file:69570-99-6.mol

Synonyms:69570-99-6;2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid;2-(4-nitrophenyl)-1H-1,3-benzodiazole-6-carboxylic acid;MFCD06660387;2-(4-nitrophenyl)-3H-benzimidazole-5-carboxylic acid;2-(4-Nitrophenyl)-1H-benzo[d]imidazole-6-carboxylic acid;SCHEMBL5217712;YSZC3296;2-(4-nitrophenyl)-3H-benzoimidazole-5-carboxylic Acid;DTXSID30442550;AKOS005257507;2-(4-nitrophenyl)benzimidazole-5-carboxylic acid;1H-Benzimidazole-6-carboxylicacid,2-(4-nitrophenyl)-;2-(4-Nitrophenyl)-1H-benzimidazole-6-carboxylic acid;2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLICACID

Suppliers and Price of 2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID 95.00%
10G
$ 2663.20

American Custom Chemicals Corporation
2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID 95.00%
1G
$ 781.01

Total 6 raw suppliers

Chemical Property of 2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:609.785°C at 760 mmHg
Flash Point:322.586°C
PSA：111.80000
Density:1.533g/cm³
LogP:3.35950
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:283.05930578
Heavy Atom Count:21
Complexity:417

Purity/Quality:

NLT 98% ^*data from raw suppliers

2-(4-NITRO-PHENYL)-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)[N+](=O)[O-]

Technology Process of 2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid

There total 5 articles about 2-(4-Nitro-phenyl)-3H-benzoimidazole-5-carboxylic acid 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: 88.0%

: 555-16-8
4-nitrobenzaldehdye

: 619-05-6
3,4-diaminobenzoic acid

: 69570-99-6
2-(4-nitrophenyl)-1H-benzimidazole-5-carboxylic acid

Guidance literature:: With sodium metabisulfite; In N,N-dimethyl-formamide; at 120 ℃; for 0.0833333h; Microwave irradiation;
DOI:10.1016/j.bioorg.2020.103956

Reference yield:

: 69570-96-3
methyl 2-(4-nitrophenyl)-1H-benzimidazole-5-carboxylate

: 69570-99-6
2-(4-nitrophenyl)-1H-benzimidazole-5-carboxylic acid

Guidance literature:: With sodium hydroxide; In methanol; water;

Reference yield:

: 555-16-8
4-nitrobenzaldehdye

: 69570-99-6
2-(4-nitrophenyl)-1H-benzimidazole-5-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: sodium metabisulfite / ethanol; water / 0 - 20 °C

2: N,N-dimethyl-formamide / 6 h / 130 °C

With sodium metabisulfite; In ethanol; water; N,N-dimethyl-formamide;
DOI:10.2174/157018011797655269