Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate

Base Information

Chemical Name:Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate
CAS No.:163213-29-4
Molecular Formula:C₉H₁₁BrN₂O₄
Molecular Weight:291.101
Hs Code.:
DSSTox Substance ID:DTXSID40363303
Wikidata:Q82146940
Mol file:163213-29-4.mol

Synonyms:Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate;163213-29-4;dimethyl 1-(2-bromoethyl)pyrazole-3,5-dicarboxylate;DTXSID40363303;MFCD00975605;AKOS005100705;AC-17208;CS-0320850;FT-0720130;7M-764;F11910;3,5-dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate

Suppliers and Price of Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate

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

SynQuest Laboratories
Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate
500 mg
$ 591.00

Matrix Scientific
Dimethyl1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate >90%
1g
$ 889.00

Matrix Scientific
Dimethyl1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate >90%
500mg
$ 657.00

Crysdot
Dimethyl1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate 95+%
1g
$ 371.00

Apolloscientific
dimethyl1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate
500mg
$ 536.00

American Custom Chemicals Corporation
DIMETHYL 1-(2-BROMOETHYL)-1H-PYRAZOLE-3,5-DICARBOXYLATE 95.00%
5MG
$ 496.23

Total 6 raw suppliers

Chemical Property of Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate

Chemical Property:

Vapor Pressure:1.05E-05mmHg at 25°C
Boiling Point:371.1±32.0 °C(Predicted)
PKA:-2.35±0.10(Predicted)
Density:1.59±0.1 g/cm3(Predicted)
XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:289.99022
Heavy Atom Count:16
Complexity:274

Purity/Quality:

98%min ^*data from raw suppliers

Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CC(=NN1CCBr)C(=O)OC

Technology Process of Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate

There total 3 articles about Dimethyl 1-(2-bromoethyl)-1H-pyrazole-3,5-dicarboxylate 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: 71.0%

: 4077-76-3
3,5-dicarbomethoxypyrazole

: 106-93-4
ethylene dibromide

: 163213-29-4
Dimethyl 1-(2-Bromoethyl)pyrazole-3,5-dicarboxylate

Guidance literature:: With potassium carbonate; In acetonitrile; for 0.416667h; Heating;
DOI:10.1021/jm9608117

Reference yield:

: 3112-31-0
3,5-pyrazoledicarboxylic acid

: 163213-29-4
Dimethyl 1-(2-Bromoethyl)pyrazole-3,5-dicarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 95 percent / HCl(g) / 2 h / Heating

2: 71 percent / K₂CO₃ / acetonitrile / 0.42 h / Heating

With hydrogenchloride; potassium carbonate; In acetonitrile;
DOI:10.1021/jm9608117