1-ethyl-3-nitro-1H-pyrazole

Base Information

Chemical Name:1-ethyl-3-nitro-1H-pyrazole
CAS No.:58793-46-7
Molecular Formula:C5H7N3O2
Molecular Weight:141.12800
Hs Code.:2933199090
DSSTox Substance ID:DTXSID00588676
Wikidata:Q82481505
Mol file:58793-46-7.mol

Synonyms:1-ethyl-3-nitro-1H-pyrazole;58793-46-7;1-ethyl-3-nitropyrazole;1-ethyl-3-nitro-pyrazole;SCHEMBL1862274;DTXSID00588676;AMY33120;BBL038911;MFCD04970018;STK312725;AKOS000310708;AKOS015922207;MCULE-1661115881;LS-10077;D80050;EN300-229750

Suppliers and Price of 1-ethyl-3-nitro-1H-pyrazole

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

TRC
1-ethyl-3-nitro-1H-pyrazole
100mg
$ 65.00

Matrix Scientific
1-Ethyl-3-nitro-1H-pyrazole 97%
1g
$ 470.00

Crysdot
1-Ethyl-3-nitro-1H-pyrazole 95+%
1g
$ 326.00

Atlantic Research Chemicals
1-Ethyl-3-nitro-1H-pyrazole 95%
250mgs:
$ 123.71

American Custom Chemicals Corporation
1-ETHYL-3-NITRO-1H-PYRAZOLE 95.00%
5MG
$ 498.87

AK Scientific
1-Ethyl-3-nitro-1H-pyrazole
1g
$ 684.00

Total 6 raw suppliers

Chemical Property of 1-ethyl-3-nitro-1H-pyrazole

Chemical Property:

Boiling Point:252.5±13.0 °C(Predicted)
PKA:-2.47±0.10(Predicted)
PSA：63.64000
Density:1.35±0.1 g/cm3(Predicted)
LogP:1.33440
XLogP3:0.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:141.053826475
Heavy Atom Count:10
Complexity:133

Purity/Quality:

99%, ^*data from raw suppliers

1-ethyl-3-nitro-1H-pyrazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCN1C=CC(=N1)[N+](=O)[O-]

Technology Process of 1-ethyl-3-nitro-1H-pyrazole

There total 2 articles about 1-ethyl-3-nitro-1H-pyrazole 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: 74.0%

: 75-03-6
ethyl iodide

: 26621-44-3
3-nitro-1H-pyrazole

: 58793-46-7
1-ethyl-3-nitro-1H-pyrazole

Guidance literature:: 3-nitro-1H-pyrazole; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; for 0.0833333h; Inert atmosphere;

ethyl iodide; In N,N-dimethyl-formamide; mineral oil; at 20 - 80 ℃; for 3h; Inert atmosphere;
DOI:10.1021/acs.jmedchem.8b01544

Reference yield: 57.0%

: 74-96-4
ethyl bromide

: 58793-46-7
1-ethyl-3-nitro-1H-pyrazole

Guidance literature:: 3-nitro-1H-pyrazole; With sodium hydride; In N,N-dimethyl-formamide; for 0.166667h;

ethyl bromide; In N,N-dimethyl-formamide; at -25 ℃; for 20h;