ガンマ-BHC溶液 - 分析標準、石油エーテル中10ug/ml , CAS No.58-89-9

CAS: 58-89-9 Cat. No.: B101467 分子式: C₆H₆Cl₆ 分子量: 290.83 Beilstein Registry Number: 1907337 EC番号: 200-401-2

GRADE & PURITY Analytical standard, 10ug/ml in petroleum ether

Synonyms

リンデン|β-HCH|1,2,3,4,5、6-ヘキサクロロシクロヘキサン|α-HCH|γ-HCH|58-89-9|β-BHC|ヘキサクロラン|Kwell|γ-BHC|六塩化ベンゼン|δ-BHC|β-ヘキサクロロシクロヘキサン|イプシロン-HCH|ヘキシサイド|ガメン|スカベン|γ-ヘキサクロロシクロヘキサン|β-リンデン|319

Storage

Room temperature

Shipped In

ノーマル

Specifications

同義語

リンデン | β-HCH | 1,2,3,4,5、6-ヘキサクロロシクロヘキサン | α-HCH | γ-HCH | 58-89-9 | β-BHC | ヘキサクロラン | Kwell | γ-BHC | 六塩化ベンゼン | δ-BHC | β-ヘキサクロロシクロヘキサン | イプシロン-HCH | ヘキシサイド | ガメン | スカベン | γ-ヘキサクロロシクロヘキサン | β-リンデン | 319

仕様と純度

分析標準、石油エーテル中10ug/ml

保管条件

Room temperature

入荷

ノーマル

等級

分析用標準物質

名前と識別子

パブケム・シド

508811325

カノニカル・スマイル

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

異性体SMILES

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

WGKドイツ

3

RTECS

GV4900000

UN番号

2761

包装グループ

I

分子量

290.83

Beilstein

1907337

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
    • 分類 Alkyl halides
      • Subclass Cyclohexyl halides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 分類: 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
• 説明: 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

化学的性質と物理的性質

• 溶解度: Insoluble in water, soluble in benzene, acetone, ether, kerosene, etc.
• 融点（°C）: 112.5°C
• 分子量: 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