Keyword(s): Surfactants
Molecule Category Free-form

Structure

InChI Key IZTDYXKTXNJHMQ-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C60H116O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-58(61)64-55-57(66-60(63)54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h57H,4-56H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C60H116O6
Molecular Weight 932.88
AlogP 19.94
Hydrogen Bond Acceptor 6.0
Number of Rotational Bond 56.0
Polar Surface Area 78.9
Heavy Atoms 66.0

Cross References

Resources Reference
CAS NUMBER 26536-13-0
NORMAN SUSDAT
PubChem 4670742
ChemSpider 3859312.0