2,3,4-Trichloroaniline - ≥98% , CAS No.634-67-3

CAS: 634-67-3 Cat. No.: T161615 Peso molecular: 196.46 Beilstein Registry Number: 12626 Número EC: 211-215-6 PubChem CID: 12464

GRADE & PURITY ≥98%

Synonyms

T0798 | F8889-9284 | Q27269540 | Aniline, 2,3,4-trichloro- | 2,3,4-TRICHLOROANILINE | SCHEMBL174757 | UNII-84PW2M8B8C | 2,4-Trichloroaniline | AS-18463 | InChI=1/C6H4Cl3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H | MFCD00042819 | Benzenamine, 2,3,4-trichloro- | B

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

T0798 | F8889-9284 | Q27269540 | Aniline, 2, 3, 4-trichloro- | 2, 3, 4-TRICHLOROANILINE | SCHEMBL174757 | UNII-84PW2M8B8C | 2, 4-Trichloroaniline | AS-18463 | InChI=1/C6H4Cl3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H, 10H | MFCD00042819 | Benzenamine, 2, 3, 4-trichloro- | B

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488181674
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181674
• Sonrisas canónicas: C1=CC(=C(C(=C1N)Cl)Cl)Cl
• IUPAC Name: 2,3,4-trichloroaniline
• InChIKey: RRJUYQOFOMFVQS-UHFFFAOYSA-N
• INCHI: 1S/C6H4Cl3N/c7-3-1-2-4(10)6(9)5(3)8/h1-2H,10H2
• Isómeros SMILES: C1=CC(=C(C(=C1N)Cl)Cl)Cl
• PubChem CID: 12464
• Peso molecular: 196.46
• Beilstein: 12626
• Reaxy-Rn: 1818168

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Chlorobenzenes Aryl chlorides Primary amines Organopnictogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Solubility in Methanol almost transparency
• Sensibilidad: Air sensitive
• Punto de ebullición (°C): 292°C(lit.)
• Punto de fusión (°C): 66-69°C
• Peso molecular: 196.500 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 194.941 Da
• Monoisotopic Mass: 194.941 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 120.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1