Structure

InChI Key ROKSAUSPJGWCSM-UWVGGRQHSA-N
Smiles CC1(C)[C@@H]2C[C@H]1C(CCO)=CC2
InChI
InChI=1S/C11H18O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,9-10,12H,4-7H2,1-2H3/t9-,10-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H18O1
Molecular Weight 166.14
AlogP 2.36
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 20.23
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 35836-73-8
NORMAN SUSDAT
PubChem 1272250
ChemSpider 1068002.0