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3-Amino-4-chlorobenzenesulfonic acid

Base Information
  • Chemical Name:3-Amino-4-chlorobenzenesulfonic acid
  • CAS No.:98-36-2
  • Molecular Formula:C6H6ClNO3S
  • Molecular Weight:207.638
  • Hs Code.:2921420090
  • European Community (EC) Number:202-661-2
  • NSC Number:59702,7538
  • UNII:4MB9E88J9W
  • DSSTox Substance ID:DTXSID4059170
  • Nikkaji Number:J4.951D
  • Wikidata:Q72434252
  • Mol file:98-36-2.mol
3-Amino-4-chlorobenzenesulfonic acid

Synonyms:3-Amino-4-chlorobenzenesulfonic acid;98-36-2;2-Chloroaniline-5-sulfonic acid;4-Chlorometanilic acid;Benzenesulfonic acid, 3-amino-4-chloro-;Metanilic acid, 4-chloro-;3-Amino-4-chlorobenzenesulphonic acid;3-Amino-4-chloro-benzenesulfonic acid;4MB9E88J9W;EINECS 202-661-2;NSC 59702;NSC-59702;3-amino-4-chlorobenzene-1-sulfonic acid;3-amino-4-chlorobenzenesulfonicacid;MFCD00035764;UNII-4MB9E88J9W;2001-24-3;SCHEMBL341943;o-Chloroaniline m-sulfonic acid;3-amino-4-chlorbenzensulfonsyre;DTXSID4059170;NSC7538;NSC-7538;NSC59702;AKOS003193910;SB77446;1-amino-6-chlorobenzene-3-sulphonic acid;AC-11815;AS-64111;CS-0206125;FT-0607596;FT-0611658;D88512;ammonia;benzene;hydrogen sulfite;hydrochloride;A845849;BENZENESULPHONIC ACID, 3-AMINO-4-CHLORO-;W-100083

Suppliers and Price of 3-Amino-4-chlorobenzenesulfonic 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
  • TCI Chemical
  • 2-Chloroaniline-5-sulfonic Acid >98.0%(HPLC)(T)
  • 25g
  • $ 115.00
  • Crysdot
  • 3-Amino-4-chlorobenzenesulfonicacid 95+%
  • 500g
  • $ 682.00
  • Chemenu
  • 3-Amino-4-chlorobenzenesulfonicacid 95%
  • 500g
  • $ 644.00
  • American Custom Chemicals Corporation
  • 3-AMINO-4-CHLORO BENZENE SULFONIC ACID 95.00%
  • 25G
  • $ 1309.77
  • American Custom Chemicals Corporation
  • 3-AMINO-4-CHLORO BENZENE SULFONIC ACID 95.00%
  • 1G
  • $ 123.90
  • Alichem
  • 3-Amino-4-chlorobenzenesulfonicacid
  • 500g
  • $ 675.22
  • AK Scientific
  • 3-Amino-4-chloro-benzenesulfonicacid
  • 25g
  • $ 114.00
  • AK Scientific
  • 3-Amino-4-chloro-benzenesulfonicacid
  • 25g
  • $ 85.00
  • AK Scientific
  • 3-Amino-4-chloro-benzenesulfonicacid
  • 5g
  • $ 47.00
  • AHH
  • 2-Chloroaniline-5-sulfonic Acid 98%
  • 250g
  • $ 350.00
Total 61 raw suppliers
Chemical Property of 3-Amino-4-chlorobenzenesulfonic acid
Chemical Property:
  • Appearance/Colour:Pinkish fine crystalline powder solid. 
  • Melting Point:300 °C 
  • Boiling Point:500oC 
  • PKA:-1.41±0.50(Predicted) 
  • PSA:88.77000 
  • Density:1.642 g/cm3 
  • LogP:2.83090 
  • Storage Temp.:2-8°C 
  • XLogP3:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:1
  • Exact Mass:206.9756919
  • Heavy Atom Count:12
  • Complexity:248
Purity/Quality:

99% *data from raw suppliers

2-Chloroaniline-5-sulfonic Acid >98.0%(HPLC)(T) *data from reagent suppliers

Safty Information:
  • Pictogram(s): IrritantXi 
  • Hazard Codes:Xi 
  • Statements: 36/37/38-43-36 
  • Safety Statements: 37/39-26-36/37 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1=CC(=C(C=C1S(=O)(=O)O)N)Cl
Technology Process of 3-Amino-4-chlorobenzenesulfonic acid

There total 2 articles about 3-Amino-4-chlorobenzenesulfonic 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:
Guidance literature:
With iron(II) sulfate; man versetzt darauf mit Aetzbaryt;
Guidance literature:
Chlorbenzol, Hydroxylamin-sulfat;
Guidance literature:
In ethanol; water; Cl(NH2)C6H3SO3H (10.0 mmol) added to suspn. oa ZnO (5.0 mmol) (H2O) withstirring, then soln. of N2C12H8 (10.0 mmol) (EtOH) added, heated at 80. degree.C for 15 min; filtered, crystd. for several d; elem. anal.;
DOI:10.1002/zaac.201000136
Refernces

Facile routes to ThIV, UIV, and NpIV phosphites and phosphates

10.1002/ejic.201100464

This research study on the synthesis of actinide(IV) phosphites and phosphates, specifically focusing on thorium(IV), uranium(IV), and neptunium(IV) compounds. The purpose of the study is to understand the behavior of actinides in the environment, particularly in the context of nuclear waste repositories, with a special emphasis on neptunium due to its long half-life and its role in long-term radioactivity. The researchers synthesized three isotypic actinide phosphites, AnIV(HPO3)2(H2O)2 (An = Th, U, Np), and a neptunium(IV) phosphate, Cs[Np(H1.5PO4)(PO4)]2, using mild hydrothermal conditions. They observed that the formation of crystalline products was highly dependent on the solubility of the products and the pH of the starting solutions. The study concluded that solubility is a fundamental property controlling the crystallization of these products, and the source of neptunium and the concentration of phosphite significantly influence the outcome. Chemicals used in the process included UO2(NO3)2·6H2O, Th(NO3)4·4H2O, caesium carbonate, phosphorous acid, and 237NpO2(s), among others.

Design and synthesis of a siderophore conjugate as a potent PSMA inhibitor and potential diagnostic agent for prostate cancer

10.1016/j.bmc.2007.11.030

The research aims to develop a siderophore conjugate that can serve as a potent prostate-specific membrane antigen (PSMA) inhibitor and a potential diagnostic agent for prostate cancer. The study incorporates a semirigid spacer in the conjugate's design to prevent competitive binding between the enzyme inhibitor and the siderophore component, which is crucial for the compound's functionality. The synthesized siderophore conjugate demonstrated potent PSMA inhibitory activity with an IC50 of 4 nM, indicating its potential for detecting prostate-derived cancer cells through magnetic resonance imaging (MRI). Key chemicals used in the research include the siderophore component, the phosphonic acid derivative, and various reagents for the synthesis of the linker and the final conjugate. The study concludes that the designed conjugate retains significant activity despite the extended linker and suggests that further MRI experimental studies on the iron and gadolinium complexes of this compound could pave the way for developing diagnostic agents for prostate cancer and potentially therapeutic agents for selective drug delivery.

Synthesis and potency of novel uracil nucleotides and derivatives as P2Y2 and P2Y6 receptor agonists

10.1016/j.bmc.2008.05.013

The research focuses on the synthesis and evaluation of novel uracil nucleotide derivatives as agonists for the P2Y2 and P2Y6 receptors, which are G protein-coupled receptors activated by nucleotides. The study involves structural modifications of the phosphate, uracil, and ribose moieties of uracil nucleotides to assess their agonist activity at human P2Y2, P2Y4, and P2Y6 receptors. Key modifications include the 2-thio modification, phosphonomethylene bridges for stability, and truncation of dinucleotide agonists. The synthesized compounds were tested for their ability to activate phospholipase C (PLC) in human astrocytoma cells stably expressing the respective P2Y receptors. The experiments utilized various analytical techniques such as NMR, HPLC, and HRMS for compound identification and purity assessment. The main reactants included uracil nucleotides, phosphonic acids, and other chemical modifiers used to synthesize the novel derivatives. The analyses were conducted to determine the EC50 values of the compounds, reflecting their potency in stimulating PLC activity, and to explore structure-activity relationships (SARs).

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