2,2',4,5,5'-Pentachlorobiphenyl standard solution - 1000μg/ml transPermethrin , CAS No.37680-73-2

CAS: 37680-73-2 Cat. No.: P141197 Formule: C₁₂H₅Cl₅ Poids moléculaire: 326.43 Beilstein Registry Number: 2507418 Numéro CE: 621-393-0

GRADE & PURITY 1000μg/ml transPermethrin

Synonyms

37680-73-2|2,2',4,5,5'-PENTACHLOROBIPHENYL|1,1'-Biphenyl, 2,2',4,5,5'-pentachloro-|PCB 101|2,4,5,2',5'-Pentachlorobiphenyl|UNII-803YVI5BNP|803YVI5BNP|1,2,4-trichloro-5-(2,5-dichlorophenyl)benzene|2,2',4,5,5'-Pentachloro-1,1'-biphenyl|DTXSID8038304|CB 101;

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonymes

37680-73-2 | 2,2',4,5,5'-PENTACHLOROBIPHENYL | 1,1'-Biphenyl, 2,2',4,5,5'-pentachloro- | PCB 101 | 2,4,5,2',5'-Pentachlorobiphenyl | UNII-803YVI5BNP | 803YVI5BNP | 1,2,4-trichloro-5-(2,5-dichlorophenyl)benzene | 2,2',4,5,5'-Pentachloro-1,1'-biphenyl | DTXSID8038304 | CB 101;

Spécifications et pureté

1000μg/ml transPermethrin

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Noms et identifiants

Sourires canoniques

C1=CC(=C(C=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl

IUPAC Name

1,2,4-trichloro-5-(2,5-dichlorophenyl)benzene

InChIKey

LAHWLEDBADHJGA-UHFFFAOYSA-N

INCHI

1S/C12H5Cl5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H

Isomères SMILES

C1=CC(=C(C=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl

WGK Allemagne

3

Numéro ONU

3432

Poids moléculaire

326.43

Beilstein

2507418

Reaxy-Rn

2507418

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2507418&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Biphenyls and derivatives
        • Level5 Chlorinated biphenyls
          • Level6 Polychlorinated biphenyls

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Biphenyls and derivatives
• Intermediate Tree Nodes: Chlorinated biphenyls
• Direct Parent: Polychlorinated biphenyls
• Alternative Parents: Dichlorobenzenes Aryl chlorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Polychlorinated biphenyl - 1,4-dichlorobenzene - Halobenzene - 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 polychlorinated biphenyls. These are organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl 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

Mécanismes d'action

Propriétés chimiques et physiques

• Poids moléculaire: 326.400 g/mol
• XLogP3: 6.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 325.88 Da
• Monoisotopic Mass: 323.883 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 259.000
• 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