Structure

InChI Key UXAIJXIHZDZMSK-FOWTUZBSSA-N
Smiles CC(C)=CCC/C(C)=C/COC(=O)Cc1ccccc1
InChI
InChI=1S/C18H24O2/c1-15(2)8-7-9-16(3)12-13-20-18(19)14-17-10-5-4-6-11-17/h4-6,8,10-12H,7,9,13-14H2,1-3H3/b16-12+

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H24O2
Molecular Weight 272.18
AlogP 4.47
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 7.0
Polar Surface Area 26.3
Molecular species None
Aromatic Rings 1.0
Heavy Atoms 20.0

Cross References

Resources Reference
CAS NUMBER 102-22-7
NORMAN SUSDAT
PubChem 5366044
ChemSpider 4517973.0