Keyword(s): Human Metabolites
Molecule Category Free-form
UNII V528UR3HZE
EPA CompTox DTXSID6049301

Structure

InChI Key OGSJMFCWOUHXHN-UHFFFAOYSA-N
Smiles CCCCCCCCCI
InChI
InChI=1S/C9H19I/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H19I1
Molecular Weight 254.05
AlogP 4.17
Number of Rotational Bond 7.0
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 4282-42-2
NORMAN SUSDAT
FDA SRS V528UR3HZE
PubChem 20275
ChemSpider 19101.0