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[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)butyl] octadecanoate

[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)butyl] octadecanoate

Systemtic Name:[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)butyl] octadecanoate
Openeye Name:[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)butyl] octadecanoate
CAS Name:octadecanoic acid [2-(hydroxymethyl)-2-(1-oxooctadecoxymethyl)butyl] ester
IUPAC Name:[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)butyl] octadecanoate
Traditional Name:stearic acid [2-methylol-2-(stearoyloxymethyl)butyl] ester
Formula: C42H82O5
MolecularWeight: 667.09748
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCCCCCCCCCCC


InChI

InChI=1S/C42H82O5/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40(44)46-38-42(6-3,37-43)39-47-41(45)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h43H,4-39H2,1-3H3


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