5-Fluoro-2-hydroxy-3-nitrobenzoic acid

Base Information

Chemical Name:5-Fluoro-2-hydroxy-3-nitrobenzoic acid
CAS No.:130046-91-2
Molecular Formula:C₇H₄FNO₅
Molecular Weight:201.111
Hs Code.:2918290000
DSSTox Substance ID:DTXSID20570518
Nikkaji Number:J758.232C
Wikidata:Q82457998
Mol file:130046-91-2.mol

Synonyms:5-Fluoro-2-hydroxy-3-nitrobenzoic acid;130046-91-2;Benzoic acid, 5-fluoro-2-hydroxy-3-nitro- (9CI);C7H4FNO5;SCHEMBL204106;5-Fluoro-3-nitro-salicylic acid;DTXSID20570518;ZHNGZUZDZKMLHL-UHFFFAOYSA-N;AKOS016009021;5-Fluoro-2-hydroxy-3-nitrobenzoicacid;DS-4492;CS-0106186;O11434

Suppliers and Price of 5-Fluoro-2-hydroxy-3-nitrobenzoic 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

TRC
5-Fluoro-2-hydroxy-3-nitrobenzoicacid
10mg
$ 45.00

Matrix Scientific
5-Fluoro-2-hydroxy-3-nitrobenzoic acid 95+%
5g
$ 908.00

Matrix Scientific
5-Fluoro-2-hydroxy-3-nitrobenzoic acid 95+%
1g
$ 341.00

Crysdot
5-Fluoro-2-hydroxy-3-nitrobenzoicacid 95+%
5g
$ 481.00

Chemenu
5-Fluoro-2-hydroxy-3-nitrobenzoicacid 95%
5g
$ 454.00

Chemcia Scientific
5-Fluoro-2-hydroxy-3-nitro-benzoicacid 95%
5 G
$ 750.00

American Custom Chemicals Corporation
5-FLUORO-2-HYDROXY-3-NITROBENZOIC ACID 95.00%
5MG
$ 501.16

Ambeed
5-Fluoro-2-hydroxy-3-nitrobenzoicacid 97%
5g
$ 348.00

Ambeed
5-Fluoro-2-hydroxy-3-nitrobenzoicacid 97%
1g
$ 117.00

Ambeed
5-Fluoro-2-hydroxy-3-nitrobenzoicacid 97%
250mg
$ 48.00

Total 8 raw suppliers

Chemical Property of 5-Fluoro-2-hydroxy-3-nitrobenzoic acid

Chemical Property:

Boiling Point:330.0±42.0 °C(Predicted)
PKA:1.67±0.20(Predicted)
PSA：103.35000
Density:1.727±0.06 g/cm3(Predicted)
LogP:1.66090
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:201.00735039
Heavy Atom Count:14
Complexity:253

Purity/Quality:

98% ^*data from raw suppliers

5-Fluoro-2-hydroxy-3-nitrobenzoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C=C(C(=C1C(=O)O)O)[N+](=O)[O-])F

Technology Process of 5-Fluoro-2-hydroxy-3-nitrobenzoic acid

There total 1 articles about 5-Fluoro-2-hydroxy-3-nitrobenzoic 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: 75.8%

: 345-16-4
5-fluoro-2-hydroxybenzoic acid

: 130046-91-2
5-fluoro-2-hydroxy-3-nitrobenzoic acid

Guidance literature:: With nitric acid; In acetonitrile;

Reference yield: 40.0%

: 100-39-0
benzyl bromide

: 130046-91-2
5-fluoro-2-hydroxy-3-nitrobenzoic acid

: 1644598-76-4
benzyl 2-(benzyloxy)-5-fluoro-3-nitrobenzoate

Guidance literature:: 5-fluoro-2-hydroxy-3-nitrobenzoic acid; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.0833333h; Microwave irradiation; Sealed tube;

benzyl bromide; In N,N-dimethyl-formamide; at 20 - 110 ℃; for 49h;
DOI:10.1002/anie.201402750

Reference yield:

: 130046-91-2
5-fluoro-2-hydroxy-3-nitrobenzoic acid

: 1644598-77-5
benzyl 5-fluoro-2-hydroxy-3-nitrobenzoate

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / N,N-dimethyl-formamide / 0.08 h / 20 °C / Microwave irradiation; Sealed tube

1.2: 49 h / 20 - 110 °C

2.1: trifluoroacetic acid / toluene / 23 h / 20 °C

With potassium carbonate; trifluoroacetic acid; In N,N-dimethyl-formamide; toluene;
DOI:10.1002/anie.201402750