Keyword(s): Surfactants
Molecule Category Free-form

Structure

InChI Key IZQRMWCVEFCDSQ-UHFFFAOYSA-N
Smiles [O-][N+]([H])([H])CCCNC(CCCCCCCCCCCCCCCCC)=O
InChI
InChI=1S/C21H44N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(24)22-19-17-20-23-25/h2-20,23H2,1H3,(H,22,24)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H44N2O2
Molecular Weight 356.34
AlogP 5.66
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 20.0
Polar Surface Area 72.26
Heavy Atoms 25.0

Cross References

Resources Reference
NORMAN SUSDAT
PubChem 87082437