4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride

Base Information

• Chemical Name: 4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride
• CAS No.: 671-89-6
• Molecular Formula: C6H4Cl3NO4S2
• Molecular Weight: 324.593
• Hs Code.: 2921499090
• European Community (EC) Number: 211-586-4
• UNII: F4KL6V26MJ
• DSSTox Substance ID: DTXSID50217409
• Nikkaji Number: J28.783K
• Wikidata: Q83093922
• Mol file: 671-89-6.mol

Synonyms:671-89-6;4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride;4-AMINO-6-CHLORO-1,3-BENZENEDISULFONYL CHLORIDE;4-Amino-6-chloro-1,3-benzenedisulfonyl Dichloride;4-Amino-6-chloro-benzene-1,3-disulfonyl dichloride;4-amino-6-chlorobenzene-1,3-disulfonyl chloride;4-Amino-6-chlorobenzene-1,3-di(sulphonyl chloride);5-Chloro-2,4-dichlorosulfonylaniline;EINECS 211-586-4;4-Chloro-6-aminobenzene-1,3-disulfonyl chloride;C6H4Cl3NO4S2;5-Chloroaniline-2,4-disulfonyl Dichloride;F4KL6V26MJ;SCHEMBL2266067;DTXSID50217409;C6-H4-Cl3-N-O4-S2;BCP24486;MFCD00024873;AKOS015898734;CS-T-02185;3-Chloro-4,6-di(chlorosulfonyl)aniline;AS-16119;FT-0661662;m-Benzenedisulfonyl chloride, 4-amino-6-chloro-;A867325;SR-01000944908;Q-200431;SR-01000944908-1;1,3-Benzenedisulfonyl dichloride, 4-amino-6-chloro-

Chemical Property of 4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride

Chemical Property:

• Vapor Pressure: 3.7E-09mmHg at 25°C
• Melting Point: 130-132 °C
• Refractive Index: 1.624
• Boiling Point: 474.2 ºC at 760 mmHg
• PKA: -5.05±0.16(Predicted)
• Flash Point: 240.6 ºC
• PSA: 111.06000
• Density: 1.834 g/cm³
• LogP: 4.52000
• Storage Temp.: 2-8°C
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 322.864733
• Heavy Atom Count: 16
• Complexity: 451

Purity/Quality:

99% ^*data from raw suppliers

4-Amino-6-chloro-1,3-benzenedisulfonylDichloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1Cl)S(=O)(=O)Cl)S(=O)(=O)Cl)N
• Uses: Chlorothiazide intermediate.

Technology Process of 4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride

There total 2 articles about 4-Amino-6-chlorobenzene-1,3-disulfonyl dichloride 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: 15.0%

3-chloro-aniline (108-42-9) → 4-amino-6-chloro-benzene-1,3-disulfonyl chloride (671-89-6)

Guidance literature:

With chlorosulfonic acid; sodium chloride; Heating;

DOI:10.1021/ac020020e

Reference yield:

→ 4-amino-6-chloro-benzene-1,3-disulfonyl chloride (671-89-6)

Guidance literature:

3-Chlor-amino u. Chlorschwefelsaeure ;

Reference yield: 85.0%

4-amino-6-chloro-benzene-1,3-disulfonyl chloride (671-89-6) → [disulfonamide-15N2]-4-amino-6-chlorobenzene-1,3-disulfonamide

Guidance literature:

With ammonia monohydrate; at 80 ℃; for 1h;

DOI:10.1021/ac020020e

upstream raw materials:

3-chloro-aniline

Downstream raw materials:

4,4'-(4-amino-6-chloro-benzene-1,3-disulfonyl)-bis-morpholine

4-butyrylamino-6-chloro-benzene-1,3-disulfonyl chloride

chloraminophenamide

4-amino-6-chloro-benzene-1,3-disulfonic acid

Refernces