4-Amino-3-(methylamino)benzoic acid

Base Information

Chemical Name:4-Amino-3-(methylamino)benzoic acid
CAS No.:66630-74-8
Molecular Formula:C8H10N2O2
Molecular Weight:166.18
Hs Code.:2922499990
DSSTox Substance ID:DTXSID90594908
Nikkaji Number:J2.325.820J
Wikidata:Q82489833
Mol file:66630-74-8.mol

Synonyms:4-Amino-3-(methylamino)benzoic acid;66630-74-8;SCHEMBL3606669;DTXSID90594908;GVPYLEGOTIRSCC-UHFFFAOYSA-N;4-amino-3-(methylamino)benzoicacid;4-amino-3-methyl-aminobenzoic acid;AKOS017515472;4-amino-3-(N-methylamino)benzoic acid;CS-0371047;EN300-151125

Suppliers and Price of 4-Amino-3-(methylamino)benzoic 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

Total 2 raw suppliers

Chemical Property of 4-Amino-3-(methylamino)benzoic acid

Chemical Property:

Boiling Point:392.0±37.0 °C(Predicted)
PKA:3.81±0.10(Predicted)
PSA：75.35000
Density:1.343±0.06 g/cm3(Predicted)
LogP:1.66290
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:166.074227566
Heavy Atom Count:12
Complexity:172

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC1=C(C=CC(=C1)C(=O)O)N

Technology Process of 4-Amino-3-(methylamino)benzoic acid

There total 5 articles about 4-Amino-3-(methylamino)benzoic 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: 100.0%

: 214778-10-6
3-methylamino-4-nitro-benzoic acid

: 66630-74-8
4-amino-3-(methylamino)benzoic acid

Guidance literature:: With hydrogen; nickel;
DOI:10.1021/op990081n

Reference yield:

: 5081-36-7
3-methoxy-4-nitrobenzoic acid

: 66630-74-8
4-amino-3-(methylamino)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 75 percent / H₂O / 100 - 105 °C

2: 96 percent / H₂ / Pd/C / methanol; tetrahydrofuran

With hydrogen; palladium on activated charcoal; In tetrahydrofuran; methanol; water;
DOI:10.1016/j.tetlet.2006.04.149

Reference yield:

: 619-14-7
3-hydroxy-4-nitro-benzoic acid

: 66630-74-8
4-amino-3-(methylamino)benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: sodium hydroxide

3: sodium hydroxide / methanol

With sodium hydroxide; In methanol;
DOI:10.1016/j.ejmech.2012.03.014