Structure

InChI Key WVRFSLWCFASCIS-UHFFFAOYSA-N
Smiles CCC1CCC(CCC(O)=O)C1
InChI
InChI=1S/C10H18O2/c1-2-8-3-4-9(7-8)5-6-10(11)12/h8-9H,2-7H2,1H3,(H,11,12)

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H18O2
Molecular Weight 170.13
AlogP 2.68
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 37.3
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 1338-24-5
NORMAN SUSDAT
PubChem 20849290
ChemSpider 17215358.0