2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole

Base Information

Chemical Name:2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole
CAS No.:15965-66-9
Molecular Formula:C₈H₆ClN₃O₂
Molecular Weight:211.608
Hs Code.:2933990090
European Community (EC) Number:696-328-2
DSSTox Substance ID:DTXSID20445373
Wikidata:Q82263743
Mol file:15965-66-9.mol

Synonyms:15965-66-9;2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole;2-chloro-1-methyl-5-nitro-1H-benzo[d]imidazole;2-chloro-1-methyl-5-nitrobenzimidazole;1H-Benzimidazole, 2-chloro-1-methyl-5-nitro-;SCHEMBL4978556;DTXSID20445373;QNYFEUMEQHKASR-UHFFFAOYSA-N;MFCD09953108;AKOS016028521;FG-0715;5-nitro-2-chloro-1-methyl-benzimidazole;AM100309;2-chloro-1-methyl-5-nitro-1h-benzimidazole;CS-0447499;2-Chloro-1-methyl-5-nitro-1H-benzoimidazole;EN300-1722745

Suppliers and Price of 2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole

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

Matrix Scientific
2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole >90%
500mg
$ 522.00

Crysdot
2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole 95+%
1g
$ 490.00

Chemenu
2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole 95%
1g
$ 463.00

Alichem
2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole
1g
$ 689.85

AK Scientific
2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole
5g
$ 4295.00

AccelPharmtech
2-chloro-1-methyl-5-nitro-1H-Benzimidazole 97.00%
25G
$ 6000.00

AccelPharmtech
2-chloro-1-methyl-5-nitro-1H-Benzimidazole 97.00%
5G
$ 3230.00

AccelPharmtech
2-chloro-1-methyl-5-nitro-1H-Benzimidazole 97.00%
1G
$ 1890.00

Total 3 raw suppliers

Chemical Property of 2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole

Chemical Property:

Melting Point:184-185 °C
Boiling Point:402.0±37.0 °C(Predicted)
PKA:1.85±0.10(Predicted)
PSA：63.64000
Density:1.58±0.1 g/cm3(Predicted)
LogP:2.65810
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:211.0148541
Heavy Atom Count:14
Complexity:245

Purity/Quality:

99% ^*data from raw suppliers

2-Chloro-1-methyl-5-nitro-1H-1,3-benzodiazole >90% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1Cl

Technology Process of 2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole

There total 10 articles about 2-chloro-1-methyl-5-nitro-1H-1,3-benzodiazole 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: 75.0%

: 5381-78-2
1-methyl-5-nitro-1H-benzo[d]imidazole

: 15965-66-9
2-chloro-1-methyl-5-nitro-1H-benzoimidazole

Guidance literature:: 1-methyl-5-nitro-1H-benzo[d]imidazole; With lithium diisopropyl amide; In tetrahydrofuran; n-heptane; ethylbenzene; at -78 ℃; for 1h;

With N-chloro-succinimide; In tetrahydrofuran; n-heptane; ethylbenzene; at 20 ℃; for 0.166667h; Further stages.;
DOI:10.1039/b707599e

Reference yield:

: 5955-72-6
2-chloro-5-nitro-1H-benzo[d]imidazole

: 74-88-4
methyl iodide

: 15965-67-0
2-chloro-1-methyl-6-nitro-1H-benzoimidazole

: 15965-66-9
2-chloro-1-methyl-5-nitro-1H-benzoimidazole

Guidance literature:: 2-chloro-5-nitro-1H-benzo[d]imidazole; With sodium hydride; In DMF (N,N-dimethyl-formamide); at 0 - 20 ℃; for 2h;

methyl iodide; In DMF (N,N-dimethyl-formamide); at 20 ℃; for 3h;