Keyword(s): Human Metabolites
Molecule Category Free-form
UNII F7LBQ7EZ7Z
EPA CompTox DTXSID7061190

Structure

InChI Key HDULBKVLSJEMGN-UHFFFAOYSA-N
Smiles C1CCC(CC1)PC1CCCCC1
InChI
InChI=1S/C12H23P/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H23P1
Molecular Weight 198.15
AlogP 4.33
Number of Rotational Bond 2.0
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 829-84-5
NORMAN SUSDAT
FDA SRS F7LBQ7EZ7Z
PubChem 13239
ChemSpider 12684.0