Structure

InChI Key WFXRJNDIBXZNJK-KVVVOXFISA-N
Smiles [NH4+].CCCCCCCCC=C/CCCCCCCC(=O)[O-]
InChI
InChI=1/C18H34O2.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h9-10H,2-8,11-17H2,1H3,(H,19,20);1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H37NO2
Molecular Weight 299.28
AlogP 6.27
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 15.0
Polar Surface Area 72.3
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 21.0

Cross References

Resources Reference
CAS NUMBER 544-60-5
NORMAN SUSDAT
FDA SRS EH7L6J9LHN