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Lindane

CAS: 58-89-9 | C6H6Cl6

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number: 58-89-9
Molecular Formula: C6H6Cl6
Molecular Weight: 290.832 g/mol

Names and Synonyms:

Lindane
Tri-6
Ameisenmittel Merck
Aplidal
Aalindan
Ovadziak
Benzene hexachloride
Nexit
Owadziak
Dol Granule
Heclotox
Quellada
Omnitox
Hexyclan
DBH
666
Entomoxan
Hexachlorocyclohexane
Hortex
Lindosep
Codechine
1,2,3,4,5,6-Hexachlorocyclohexane
γ-Hexachlorobenzene
γ-Hexachlorane
γ-Hexachloran
Nicochloran
Mszycol
Lendine
Gammalin
Lidenal
Lindatox
HCCH
Gammalin 20
Kokotine
Arbitex
Gammexane
Sang-gamma
γ-HCH
Lintox
Lentox
HCH
Bentox 10
Gamacid
TAP 85
Pedraczak
Streunex
γ-BHC
Lorexane
γ-Lindane
Lindane
Kwell
Jacutin
HGI
γ-Hexachlorocyclohexane
γ-1,2,3,4,5,6-Hexachlorocyclohexane
Hexachlorane
Hexachloran
Gexane
Gamma-HCH
Gamma benzene hexachloride
BHC
Bexol
γ-Benzene hexachloride
Ben-Hex
BBH
Aphtiria
Aparasin
Agrocide WP
Agrocide III
Agrocide
Aficide
ENT 7,796
(1α,2α,3β,4α,5α,6β)-1,2,3,4,5,6-Hexachlorocyclohexane
Cyclohexane, 1,2,3,4,5,6-hexachloro-, γ-
Cyclohexane, 1,2,3,4,5,6-hexachloro-, (1α,2α,3β,4α,5α,6β)-
Gammaxene
Scabecid
Scabene
Gamene
Esoderm
Lindafor
Viton
Prodactif
Kanodane
Gamacide
Arcotal S
Gamacide 20
BHC (insecticide)
Bercema-Spritz-Lindan 50
Nexit Stark
Gamoline
Lintox 3
Inexit
Hexatin
γ-Benzohexachloride
Spritzlindane
PLK
Lasochron
Benhexol
Verindal Ultra
Hilbeech
Geobilan
Geolin G 3
γ-666
Mglawik L
Fenoform forte
Hungaria L 7
Forst-Nexen
HCC
Lindex
Linvur
Hexaverm
Devoran
Chloresene
Neo-Scabicidol
Hexicide
Spruehpflanzol
Spritz-Rapidin
Pflanzol
Nexol E
Nexen FB
Milbol 49
Gammaterr
Hexa
Drilltox-Spezial Aglukon
Detmol Extract
Celanex

Identifiers:

SMILES:
Cl[C@H]1[C@H](Cl)[C@@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H]1Cl
InChI:
InChI=1/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5+,6+

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

All Properties

Comprehensive physical and chemical properties

Physical Properties

Property Value Source
molecular_mass 290.83 g/mol Legacy Database
density 1.85 g/cm³ Legacy Database
cas-boiling-point 323.4 °C @ Press: 760 Torr None Legacy Database
cas-canonical-smile ClC1C(Cl)C(Cl)C(Cl)C(Cl)C1Cl None Legacy Database
cas-density 1.85 g/cm3 None Legacy Database
cas-inchi InChI=1/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5+,6+ None Legacy Database
cas-inchi-key InChIKey=JLYXXMFPNIAWKQ-GNIYUCBRNA-N None Legacy Database
cas-melting-point 112.5 °C None Legacy Database
cas-name Lindane None Legacy Database
LogP 3.644400000000001 RDKit

Molecular

Property Value Source
Molecular Weight 290.832 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 287.860066272 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 12 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 0 count RDKit
Hydrogen Bond Donors 0 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 0 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 0 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 0.0 Ų RDKit

Molar

Property Value Source
Molar Refractivity 57.846000000000025 RDKit

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