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hexadecyl 2-octyloctadecanoate

hexadecyl 2-octyloctadecanoate

Systemtic Name:hexadecyl 2-octyloctadecanoate
Openeye Name:hexadecyl 2-octyloctadecanoate
CAS Name:2-octyloctadecanoic acid hexadecyl ester
IUPAC Name:hexadecyl 2-octyloctadecanoate
Traditional Name:2-octylstearic acid cetyl ester
Formula: C42H84O2
MolecularWeight: 621.11516
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC


InChI

InChI=1S/C42H84O2/c1-4-7-10-13-16-18-20-22-24-26-28-30-33-36-39-41(38-35-32-15-12-9-6-3)42(43)44-40-37-34-31-29-27-25-23-21-19-17-14-11-8-5-2/h41H,4-40H2,1-3H3


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