Keyword(s): Human Metabolites
Molecule Category Free-form
UNII GQ3RVU6PSC
EPA CompTox DTXSID1060849

Structure

InChI Key BLXSFCHWMBESKV-UHFFFAOYSA-N
Smiles CCCCCI
InChI
InChI=1S/C5H11I/c1-2-3-4-5-6/h2-5H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H11I1
Molecular Weight 197.99
AlogP 2.61
Number of Rotational Bond 3.0
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 628-17-1
NORMAN SUSDAT
FDA SRS GQ3RVU6PSC
PubChem 12335
ChemSpider 11830.0