Cas no 642-95-5 (2,3,4-tribromoaniline)

2,3,4-Tribromoaniline is a brominated aromatic amine with the molecular formula C?H?Br?N. This compound is characterized by the substitution of three bromine atoms at the 2, 3, and 4 positions of the aniline ring, imparting high electron-withdrawing properties and enhanced reactivity in electrophilic substitution reactions. It serves as a valuable intermediate in organic synthesis, particularly in the preparation of agrochemicals, pharmaceuticals, and specialty dyes. The presence of multiple bromine atoms contributes to its utility in cross-coupling reactions and as a precursor for further functionalization. Its well-defined structure and stability under controlled conditions make it a reliable reagent for research and industrial applications requiring precise brominated aromatic frameworks.
2,3,4-tribromoaniline structure
2,3,4-tribromoaniline structure
Product Name:2,3,4-tribromoaniline
CAS No:642-95-5
MF:C6H4Br3N
MW:329.814659118652
CID:1681387
PubChem ID:14877221
Update Time:2025-06-07

2,3,4-tribromoaniline Chemical and Physical Properties

Names and Identifiers

    • 2,3,4-tribromoaniline
    • CTK2B4853
    • 2,3,4-tribromo-5-trifluoromethylsulfanyl-pyrrole
    • tribromoaniline
    • 2,3,4-Tribrom-5-(trifluormethylthio)-pyrrol
    • 2,3,4-Tribrom-5-(trifluormethylthio)pyrrol
    • 2,3,4-tribromo-aniline
    • 2,3,4-tribromo-5-trifluoromethylsulfanyl-1H-pyrrole
    • 1H-Pyrrole, 2,3,4-tribromo-5-[(trifluoromethyl)thio]-
    • 2,3,4-Tribrom-anilin
    • CTK2B4853; 2,3,4-tribromo-5-trifluoromethylsulfanyl-pyrrole; tribromoaniline; 2,3,4-Tribrom-5-(trifluormethylthio)-pyrrol; 2,3,4-Tribrom-5-(trifluormethylthio)pyrrol; 2,3,4-tribromo-aniline; 2,3,4-tribromo-5-trifluoromethylsulfanyl-1H-pyrrole; 1H-Pyrrole, 2,3,4-tribromo-5-[(trifluoromethyl)thio]-; 2,3,4-Tribrom-anilin;
    • 642-95-5
    • SCHEMBL80034
    • G64784
    • Inchi： 1S/C6H4Br3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2
    • InChI Key： MDRUKDLYOLTXBU-UHFFFAOYSA-N
    • SMILES： BrC1C(=C(C=CC=1N)Br)Br

Computed Properties

  • Exact Mass: 326.78932
  • Monoisotopic Mass: 326.78939g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 120
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Density: 2.351
  • Boiling Point: 325.256°C at 760 mmHg
  • Flash Point: 150.509°C
  • Refractive Index: 1.689
  • PSA: 26.02

2,3,4-tribromoaniline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A013020726-250mg
2,3,4-Tribromoaniline
 642-95-5 97%
250mg
 $494.40 2023-09-01
Alichem
A013020726-500mg
2,3,4-Tribromoaniline
 642-95-5 97%
500mg
 $855.75 2023-09-01
Alichem
A013020726-1g
2,3,4-Tribromoaniline
 642-95-5 97%
1g
 $1579.40 2023-09-01

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