Keyword(s): Surfactants
Molecule Category Free-form

Structure

InChI Key RCYGODSXLIRWOP-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCOCC(C)OCC(C)OCCOCCOCCOCCO
InChI
InChI=1S/C27H56O7/c1-4-5-6-7-8-9-10-11-12-13-14-16-32-24-26(2)34-25-27(3)33-23-22-31-21-20-30-19-18-29-17-15-28/h26-28H,4-25H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H56O7
Molecular Weight 492.4
AlogP 5.17
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 29.0
Polar Surface Area 75.61
Heavy Atoms 34.0

Cross References

Resources Reference
NORMAN SUSDAT