1,2,3,4-Tetrachlorobenzene solution - analytical standard, 0.105mg/ml in isooctane , CAS No.634-66-2

CAS: 634-66-2 Cat. No.: T107546 Formule: C₆H₂Cl₄ Poids moléculaire: 215.89 Beilstein Registry Number: 1910025 Numéro CE: 211-214-0

GRADE & PURITY Analytical standard, 0.105mg/ml in isooctane

Synonyms

1,2,3,4-TETRACHLOROBENZENE|634-66-2|Benzene, 1,2,3,4-tetrachloro-|Tetrachlorobenzene|1,2,3,4-benzene tetrachloride|MH0UY3V1KE|1,2,3,4-Tetrachlorbenzol|1,2,3,4-Tetrachloro-Benzene|DTXSID6026088|CHEBI:18855|1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrachloro-|NSC-

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Synonymes

1,2,3,4-TETRACHLOROBENZENE | 634-66-2 | Benzene, 1,2,3,4-tetrachloro- | Tetrachlorobenzene | 1,2,3,4-benzene tetrachloride | MH0UY3V1KE | 1,2,3,4-Tetrachlorbenzol | 1,2,3,4-Tetrachloro-Benzene | DTXSID6026088 | CHEBI:18855 | 1,3-Cyclohexadien-5-yne, 1,2,3,4-tetrachloro- | NSC-

Spécifications et pureté

analytical standard, 0.105mg/ml in isooctane

Conditions de stockage de stockage

Room temperature

Expédié en

FedEx DG Service

Grade

Étalon d'analyse

Noms et identifiants

Pubchem Sid

528753580

Sourires canoniques

C1=CC(=C(C(=C1Cl)Cl)Cl)Cl

IUPAC Name

1,2,3,4-tetrachlorobenzene

InChIKey

GBDZXPJXOMHESU-UHFFFAOYSA-N

INCHI

1S/C6H2Cl4/c7-3-1-2-4(8)6(10)5(3)9/h1-2H

Isomères SMILES

C1=CC(=C(C(=C1Cl)Cl)Cl)Cl

WGK Allemagne

3

RTECS

DB9440000

Numéro ONU

3077

Groupe d'emballage

III

Poids moléculaire

215.89

Beilstein

1910025

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Chlorobenzenes
• Alternative Parents: Aryl chlorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Chlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
• External Descriptors: tetrachlorobenzene

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

Cibles associées (humaines)

AR Tclin Androgen Receptor (11781 Activities)

Discover Target: AR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: Light sensitive.
• Point d'éclair (°F): 235.4 °F
• Point d'éclair (°C): 110℃
• Point d'ébullition (°C): 254°C
• Point de fusion (°C): 44-48°C
• Poids moléculaire: 215.900 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 215.888 Da
• Monoisotopic Mass: 213.891 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 102.000
• 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