Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 9HLM6UQ45W
EPA CompTox DTXSID9062225

Structure

InChI Key RBBNTRDPSVZESY-UHFFFAOYSA-N
Smiles ClCCCCCCCCCCCl
InChI
InChI=1S/C10H20Cl2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H20Cl2
Molecular Weight 210.09
AlogP 4.58
Number of Rotational Bond 9.0
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 2162-98-3
NORMAN SUSDAT
FDA SRS 9HLM6UQ45W
PubChem 75101
ChemSpider 67652.0