PCB No(Aroclor 1260)158 solution - 100 ng/ul in cyclohexane，10ML , CAS No.11096-82-5

CAS: 11096-82-5 Cat. No.: P118404 Formula: C₁₂H₄Cl₆ Peso molecolare: 360.88 Numero EC: 680-469-1

GRADE & PURITY 100 ng/ul in cyclohexane，10ML

Synonyms

Chlorodiphenyl (60% Cl) | Askarel | 1,2,3-trichloro-4-(2,3,4-trichlorophenyl)benzene | PCB 128 | SCHEMBL308791 | InChI=1/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4 | 2,3,4,2',3',4'-Hexachlorobiphenyl | DSSTox_RID_75367 | Q26841006 | P

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Sinonimi

Chlorodiphenyl (60% Cl) | Askarel | 1,2,3-trichloro-4-(2,3,4-trichlorophenyl)benzene | PCB 128 | SCHEMBL308791 | InChI=1/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4 | 2,3,4,2',3',4'-Hexachlorobiphenyl | DSSTox_RID_75367 | Q26841006 | P

Specifiche e purezza

100 ng/ul in cyclohexane，10ML

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

FedEx DG Service

Nomi e identificatori

Pubchem Sid

528771227

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528771227

Sorrisi canonici

C1=CC(=C(C(=C1C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl)Cl)Cl

IUPAC Name

1,2,3-trichloro-4-(2,3,4-trichlorophenyl)benzene

InChIKey

BTAGRXWGMYTPBY-UHFFFAOYSA-N

INCHI

1S/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4H

Isomeri SMILES

C1=CC(=C(C(=C1C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl)Cl)Cl

WGK Germania

2

Numero UN

1145

Gruppo di imballaggio

II

Peso molecolare

360.88

Reaxy-Rn

2508232

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2508232&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: Chlorobenzenes Aryl chlorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Polychlorinated biphenyl - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Peso molecolare: 360.900 g/mol
• XLogP3: 7.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 359.841 Da
• Monoisotopic Mass: 357.844 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 258.000
• 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