4,6-Dibromo-2,3-dichloroaniline

Base Information

• Chemical Name: 4,6-Dibromo-2,3-dichloroaniline
• CAS No.: 113571-15-6
• Molecular Formula: C₆H₃Br₂Cl₂N
• Molecular Weight: 319.811
• Hs Code.: 2921420090
• European Community (EC) Number: 621-107-4
• DSSTox Substance ID: DTXSID30380307
• Wikidata: Q82170492
• ChEMBL ID: CHEMBL4961279
• Mol file: 113571-15-6.mol

Synonyms:4,6-Dibromo-2,3-dichloroaniline;113571-15-6;Benzenamine, 4,6-dibromo-2,3-dichloro-;CHEMBL4961279;SCHEMBL17183958;DTXSID30380307;IPWGDMQXLGFBLC-UHFFFAOYSA-N;MFCD00052815;STL089379;AKOS000113918;4,6-Dibromo-2,3-dichloro-phenylamine;4,6-Dibromo-2,3-dichloroaniline, 97%;PS-10165;BB 0244114;CS-0312911;FT-0617232;E83837;A803071;J-002996

Chemical Property of 4,6-Dibromo-2,3-dichloroaniline

Chemical Property:

• Vapor Pressure: 0.000403mmHg at 25°C
• Melting Point: 104-108 °C(lit.)
• Boiling Point: 316.7°Cat760mmHg
• PKA: -1.17±0.10(Predicted)
• Flash Point: 145.3°C
• PSA: 26.02000
• Density: 2.161g/cm³
• LogP: 4.68180
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Methanol
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 318.79888
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

98%min ^*data from raw suppliers

4,6-Dibromo-2,3-dichloroaniline ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=C(C(=C(C(=C1Br)Cl)Cl)N)Br
• Uses: 4,6-Dibromo-2,3-dichloroaniline is a bromination product of dichloro-substituted aniline. 4,6-Dibromo-2,3-dichloroaniline is used in the preparation of benzothiazoles.

Technology Process of 4,6-Dibromo-2,3-dichloroaniline

There total 1 articles about 4,6-Dibromo-2,3-dichloroaniline 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:

2,3-dichloroaniline (608-27-5) → 4,6-Dibromo-2,3-dichloroaniline (113571-15-6)

Guidance literature:

With bromine; at 20 - 25 ℃; for 0.0333333h; pH=8.5 - 9; aq. buffer;

DOI:10.1134/S1070427211100132

Reference yield:

4,6-Dibromo-2,3-dichloroaniline (113571-15-6) + trifluoroacetic anhydride (407-25-0) → C8H2Br2Cl2F3NO

Guidance literature:

In toluene; at 65 ℃; for 2h;

DOI:10.1134/S1070427211100132

upstream raw materials:

2,3-dichloroaniline

Refernces