toxaphene

Ligand id: 2830

Name: toxaphene

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 0
Molecular weight 407.81
XLogP 4.52
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1,2,3,4,7,7-hexachloro-6,6-bis(chloromethyl)-5-methylidenebicyclo[2.2.1]heptane
Synonyms
octachlorocamphene
Database Links
CAS Registry No. 8001-35-2 (source: Scifinder)
ChEBI CHEBI:77850
ChEMBL Ligand CHEMBL1566504
PubChem CID 5284469
Search Google for chemical match using the InChIKey OEJNXTAZZBRGDN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone OEJNXTAZZBRGDN
Search UniChem for chemical match using the InChIKey OEJNXTAZZBRGDN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone OEJNXTAZZBRGDN
Wikipedia Toxaphene
Comments
Toxaphene is a complex mixture of hundreds of different chlorinated compounds. The structure shown here is representative of one of these compounds and is the same as the one displayed in the PubChem entry linked to above.