δ-HCH solution - analytical standard, 50ug/ml in methanol:toluene(4:1) , CAS No.319-86-8

CAS: 319-86-8 Cat. No.: H117405 Fórmula: C₆H₆Cl₆ Peso molecular: 290.83 Beilstein Registry Number: 1907334 Número CE: 206-272-9

GRADE & PURITY Analytical standard, 50ug/ml in methanol:toluene(4:1)

Synonyms

lindane|beta-HCH|1,2,3,4,5,6-Hexachlorocyclohexane|alpha-HCH|gamma-HCH|58-89-9|beta-BHC|Hexachlorane|Kwell|gamma-BHC|Benzene hexachloride|delta-BHC|BETA-HEXACHLOROCYCLOHEXANE|epsilon-HCH|Hexicide|Gamene|Scabene|gamma-hexachlorocyclohexane|beta-Lindane|319

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

lindane | beta-HCH | 1,2,3,4,5,6-Hexachlorocyclohexane | alpha-HCH | gamma-HCH | 58-89-9 | beta-BHC | Hexachlorane | Kwell | gamma-BHC | Benzene hexachloride | delta-BHC | BETA-HEXACHLOROCYCLOHEXANE | epsilon-HCH | Hexicide | Gamene | Scabene | gamma-hexachlorocyclohexane | beta-Lindane | 319

Especificações e pureza

analytical standard, 50ug/ml in methanol:toluene(4:1)

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Grau

Analytical standard

Nomes e identificadores

Pubchem Sid

528768901

Sorrisos canónicos

C1(C(C(C(C(C1Cl)Cl)Cl)Cl)Cl)Cl

IUPAC Name

1,2,3,4,5,6-hexachlorocyclohexane

InChIKey

JLYXXMFPNIAWKQ-UHFFFAOYSA-N

INCHI

1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H

SMILES isoméricas

C1(C(C(C(C(C1Cl)Cl)Cl)Cl)Cl)Cl

WGK Alemanha

1

Número UN

2761

Grupo de embalagem

I

Peso molecular

290.83

Beilstein

1907334

Reaxy-Rn

1907331

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1907331&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Alkyl halides
      • Subclass Cyclohexyl halides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Alkyl halides
• Subclass: Cyclohexyl halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexyl halides
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexyl halide - Hydrocarbon derivative - Organochloride - Alkyl chloride - Aliphatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as cyclohexyl halides. These are organohalogen compounds containing a monocyclic cyclohexane moiety that is substituted at one or more positions by an halogen atom.
• External Descriptors: a small molecule

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

Propriedades químicas e físicas

• Sensibilidade: light sensitive
• Ponto de inflamação (°C): 11°C
• Ponto de fusão (°C): 136-140°C
• Peso molecular: 290.800 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 289.857 Da
• Monoisotopic Mass: 287.86 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 104.000
• 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