Keyword(s): Surfactants
Molecule Category Free-form

Structure

InChI Key DOODZSYDMXRCDI-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCCOCC(OCC(OCC(C)OCCOCCOCCO)C)C
InChI
InChI=1S/C29H60O7/c1-5-6-7-8-9-10-11-12-13-14-15-16-18-33-24-27(2)35-26-29(4)36-25-28(3)34-23-22-32-21-20-31-19-17-30/h27-30H,5-26H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C29H60O7
Molecular Weight 520.43
AlogP 5.94
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 30.0
Polar Surface Area 75.61
Heavy Atoms 36.0

Cross References

Resources Reference
NORMAN SUSDAT