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octadecyl 2-hexyloctadecanoate

octadecyl 2-hexyloctadecanoate

Systemtic Name:octadecyl 2-hexyloctadecanoate
Openeye Name:octadecyl 2-hexyloctadecanoate
CAS Name:2-hexyloctadecanoic acid octadecyl ester
IUPAC Name:octadecyl 2-hexyloctadecanoate
Traditional Name:2-hexylstearic acid stearyl ester
Formula: C42H84O2
MolecularWeight: 621.11516
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCC)CCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CCCCCC)CCCCCCCCCCCCCCCC


InChI

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


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