Keyword(s): Human Metabolites
Molecule Category Free-form
UNII T5W8NXQ34J
EPA CompTox DTXSID4061593

Structure

InChI Key FOTXAJDDGPYIFU-UHFFFAOYSA-N
Smiles CCC1CC1
InChI
InChI=1S/C5H10/c1-2-5-3-4-5/h5H,2-4H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H10
Molecular Weight 70.08
AlogP 1.81
Number of Rotational Bond 1.0
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 1191-96-4
NORMAN SUSDAT
FDA SRS T5W8NXQ34J
PubChem 70933
ChemSpider 64095.0