Keyword(s): Surfactants
Molecule Category Salt-form

Structure

InChI Key FZACGOAIMANYDC-UHFFFAOYSA-N
Smiles [Na+].CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO[S]([O-])(=O)=O
InChI
InChI=1S/C26H54O11S/c1-2-3-4-5-6-7-8-9-10-11-12-30-13-14-31-15-16-32-17-18-33-19-20-34-21-22-35-23-24-36-25-26-37-38(27,28)29/h2-26H2,1H3,(H,27,28,29)

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H54O11S1
Molecular Weight 574.34
AlogP 3.84
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 33.0
Polar Surface Area 128.21
Heavy Atoms 38.0

Cross References

Resources Reference
NORMAN SUSDAT
PubChem 105324
ChemSpider 95007.0