1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde

Base Information

Chemical Name:1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde
CAS No.:499993-58-7
Molecular Formula:C6H7N3O3
Molecular Weight:169.13808
Hs Code.:
DSSTox Substance ID:DTXSID90448735
Wikidata:Q82267861
Mol file:499993-58-7.mol

Synonyms:1,4-DIMETHYL-5-NITRO-1H-IMIDAZOLE-2-CARBALDEHYDE;499993-58-7;DTXSID90448735;AKOS006228521

Suppliers and Price of 1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde

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

Total 2 raw suppliers

Chemical Property of 1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde

Chemical Property:

Boiling Point:364.3±34.0 °C(Predicted)
PKA:-0.33±0.60(Predicted)
PSA：80.71000
Density:1.44±0.1 g/cm3(Predicted)
LogP:0.97240
XLogP3:-0.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:169.04874109
Heavy Atom Count:12
Complexity:203

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(N(C(=N1)C=O)C)[N+](=O)[O-]

Technology Process of 1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde

There total 2 articles about 1,4-Dimethyl-5-nitro-1H-imidazole-2-carbaldehyde 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: 80.0%

: 104575-39-5
1,4-dimethyl-2-(hydroxymethyl)-5-nitroimidazole

: 499993-58-7
1,4-dimethyl-5-nitro-1H-2-imidazolcarbaldehyde

Guidance literature:: With manganese(IV) oxide; In toluene; for 4h; Heating;
DOI:10.1021/jm021030a

Reference yield:

: 57658-79-4
1,4-dimethyl-5-nitro-1H-imidazole

: 499993-58-7
1,4-dimethyl-5-nitro-1H-2-imidazolcarbaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / dimethylsulfoxide / 48 h / 140 °C

2: 80 percent / MnO₂ / toluene / 4 h / Heating

With manganese(IV) oxide; In dimethyl sulfoxide; toluene;
DOI:10.1021/jm021030a