Keyword(s): Human Metabolites
Molecule Category Free-form
UNII D6SQ6ZJS4L
EPA CompTox DTXSID9066465

Structure

InChI Key FHQCFGPKNSSISL-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCCI
InChI
InChI=1S/C14H29I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-14H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H29I1
Molecular Weight 324.13
AlogP 6.12
Number of Rotational Bond 12.0
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 19218-94-1
NORMAN SUSDAT
FDA SRS D6SQ6ZJS4L
PubChem 29507
ChemSpider 27431.0