2-(Dimethylamino)-5-nitrobenzoic acid

Base Information

Chemical Name:2-(Dimethylamino)-5-nitrobenzoic acid
CAS No.:4405-28-1
Molecular Formula:C9H10N2O4
Molecular Weight:210.189
Hs Code.:2922499990
DSSTox Substance ID:DTXSID60384434
Wikidata:Q82176576
ChEMBL ID:CHEMBL1331129
Mol file:4405-28-1.mol

Synonyms:2-(dimethylamino)-5-nitrobenzoic acid;4405-28-1;2-dimethylamino-5-nitro-benzoic Acid;2-(DIMETHYLAMINO)-5-NITROBENZOICACID;Oprea1_591499;MLS000393594;SCHEMBL3885646;CHEMBL1331129;DTXSID60384434;DOWIJKGYCPKWNC-UHFFFAOYSA-N;HMS2536O14;MFCD01566151;STL377098;2-dimethylamino-5-nitro benzoic acid;AKOS000109254;SB79165;AS-63321;SMR000247806;BB 0246163;CS-0036941;FT-0723768;EN300-09848;W11227;A1-31391;Z56989621

Suppliers and Price of 2-(Dimethylamino)-5-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
2-(dimethylamino)-5-nitrobenzoicAcid
100mg
$ 65.00

Crysdot
2-(Dimethylamino)-5-nitrobenzoicacid 95+%
1g
$ 564.00

Crysdot
2-(Dimethylamino)-5-nitrobenzoicacid 95+%
5g
$ 1697.00

American Custom Chemicals Corporation
2-(DIMETHYLAMINO)-5-NITROBENZOIC ACID 95.00%
5G
$ 1295.03

American Custom Chemicals Corporation
2-(DIMETHYLAMINO)-5-NITROBENZOIC ACID 95.00%
2.5G
$ 1065.66

American Custom Chemicals Corporation
2-(DIMETHYLAMINO)-5-NITROBENZOIC ACID 95.00%
1G
$ 765.23

AK Scientific
2-(dimethylamino)-5-nitrobenzoicacid
1g
$ 614.00

AK Scientific
2-(dimethylamino)-5-nitrobenzoicacid
100mg
$ 218.00

A1 Biochem Labs
2-(Dimethylamino)-5-nitrobenzoicacid 95%
5 g
$ 1100.00

Total 7 raw suppliers

Chemical Property of 2-(Dimethylamino)-5-nitrobenzoic acid

Chemical Property:

Vapor Pressure:1.1E-06mmHg at 25°C
Refractive Index:1.63
Boiling Point:387.1 °C at 760 mmHg
Flash Point:187.9 °C
PSA：86.36000
Density:1.384 g/cm³
LogP:1.88220
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:210.06405680
Heavy Atom Count:15
Complexity:261

Purity/Quality:

99% ^*data from raw suppliers

2-(dimethylamino)-5-nitrobenzoicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-(Dimethylamino)-5-nitrobenzoic acid

There total 5 articles about 2-(Dimethylamino)-5-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: 91.0%

: 2516-96-3
2-chloro-5-nitrobenzoic acid

: 124-40-3
dimethyl amine

: 4405-28-1
2-(dimethylamino)-5-nitrobenzoic acid

Guidance literature:: In water; at 20 - 65 ℃; for 3h; Product distribution / selectivity;

Reference yield: 88.2%

: 7304-32-7
2-fluoro-5-nitrobenzoic acid

: 124-40-3
dimethyl amine

: 4405-28-1
2-(dimethylamino)-5-nitrobenzoic acid

Guidance literature:: In 1,4-dioxane; at 20 ℃; for 2h;
DOI:10.1016/j.ejmech.2021.113316

Reference yield:

: 17417-09-3
2-fluoro-5-nitrobenzonitrile

: 4405-28-1
2-(dimethylamino)-5-nitrobenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: sulfuric acid / water / 2 h / 100 °C

2: potassium carbonate / N,N-dimethyl-formamide / 2 h / 20 °C

With sulfuric acid; potassium carbonate; In water; N,N-dimethyl-formamide;
DOI:10.1016/j.bmc.2021.116396