Lindane - analytical standard , CAS No.58-89-9

CAS: 58-89-9 Cat. No.: L101460 Formula: C₆H₆Cl₆ Molecular Weight: 290.83 Beilstein Registry Number: 1907337 EC Number: 200-401-2

GRADE & PURITY Analytical standard

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

FedEx DG Service

Specifications

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

Specifications & Purity

analytical standard

Storage

Room temperature

Shipped In

FedEx DG Service

Grade

Analytical standard

Names and Identifiers

Pubchem Sid

504750408

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504750408

Canonical Smiles

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

Isomeric SMILES

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

WGK Germany

3

RTECS

GV4900000

UN Number

2761

Packing Group

I

Molecular Weight

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
    • Class Alkyl halides
      • Subclass Cyclohexyl halides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: 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
• Description: 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

Chemical and Physical Properties

• Solubility: Insoluble in water, soluble in benzene, acetone, ether, kerosene, etc.
• Melt Point(°C): 112.5°C
• Molecular Weight: 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

Frequently Asked Questions

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What does analytical standard mean?

analytical standard is a defined analytical purity tier suitable for quantitative analytical methods. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. analytical standard is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 58-89-9, the molecular formula is C6H6Cl6, and the molecular weight is 290.83 g/mol. InChIKey JLYXXMFPNIAWKQ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.