5-(3-nitrophenyl)-1H-pyrazole-3-carboxylic acid

Base Information

Chemical Name:5-(3-nitrophenyl)-1H-pyrazole-3-carboxylic acid
CAS No.:899714-76-2
Molecular Formula:C₁₀H₇N₃O₄
Molecular Weight:233.183
Hs Code.:2933199090
DSSTox Substance ID:DTXSID70378046
Wikidata:Q82167493
ChEMBL ID:CHEMBL1331707
Mol file:899714-76-2.mol

Synonyms:5-(3-nitrophenyl)-1H-pyrazole-3-carboxylic acid;899714-76-2;1557038-82-0;3-(3-nitrophenyl)-1H-pyrazole-5-carboxylic acid;MFCD05864799;MLS000673847;CHEMBL1331707;SCHEMBL15472022;DTXSID70378046;HMS2718C22;BBL030429;STK660154;AKOS000275837;AKOS005254272;DS-0111;SMR000315088;BB 0241018;EU-0033041;FT-0701569;5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylicacid;A860966;A921855;SR-01000147384;3-(3-nitrophenyl)-1{H}-pyrazole-5-carboxylic acid;5-(3-Nitro-phenyl)-2H-pyrazole-3-carboxylic acid;SR-01000147384-1;F1967-0140;5-(3-NITRO-PHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID

Suppliers and Price of 5-(3-nitrophenyl)-1H-pyrazole-3-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

SynChem
5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylic acid 95+%
5 g
$ 450.00

SynChem
5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylic acid 95+%
1 g
$ 150.00

SynChem
5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylic acid 95+%
10 g
$ 700.00

American Custom Chemicals Corporation
5-(3-NITROPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID 95.00%
50MG
$ 650.27

Abosyn
5-(3-nitrophenyl)-1H-pyrazole-3-carboxylicacid 95-98%
1g
$ 630.00

Total 20 raw suppliers

Chemical Property of 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylic acid

Chemical Property:

Vapor Pressure:3.01E-14mmHg at 25°C
Refractive Index:1.678
Boiling Point:579°C at 760 mmHg
Flash Point:304°C
PSA：111.80000
Density:1.547g/cm³
LogP:2.20630
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:233.04365571
Heavy Atom Count:17
Complexity:317

Purity/Quality:

97% ^*data from raw suppliers

5-(3-Nitrophenyl)-1H-pyrazole-3-carboxylic acid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)[N+](=O)[O-])C2=NNC(=C2)C(=O)O

Technology Process of 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylic acid

There total 3 articles about 5-(3-nitrophenyl)-1H-pyrazole-3-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:

: 1025724-57-5,1316754-31-0
ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate

: 899714-76-2
C₁₀H₇N₃O₄

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; at 20 ℃; for 12h;
DOI:10.1016/j.bmcl.2011.05.105

Reference yield:

: 57961-49-6
ethyl 4-(3-nitrophenyl)-2,4-dioxobutanoate

: 899714-76-2
C₁₀H₇N₃O₄

Guidance literature:: Multi-step reaction with 2 steps

1: acetic acid; hydrazine / 12 h / 20 °C

2: lithium hydroxide / tetrahydrofuran / 12 h / 20 °C

With acetic acid; lithium hydroxide; hydrazine; In tetrahydrofuran;
DOI:10.1016/j.bmcl.2011.05.105

Reference yield:

: 121-89-1
3-Nitroacetophenone

: 899714-76-2
C₁₀H₇N₃O₄

Guidance literature:: Multi-step reaction with 3 steps

1: sodium methylate / diethyl ether / 15 h / 20 °C

2: acetic acid; hydrazine / 12 h / 20 °C

3: lithium hydroxide / tetrahydrofuran / 12 h / 20 °C

With sodium methylate; acetic acid; lithium hydroxide; hydrazine; In tetrahydrofuran; diethyl ether;
DOI:10.1016/j.bmcl.2011.05.105