[4,4-diethoxy-2-(hydroxymethyl)butyl] octadecanoate

Systemtic Name: [4,4-diethoxy-2-(hydroxymethyl)butyl] octadecanoate Openeye Name: [4,4-diethoxy-2-(hydroxymethyl)butyl] octadecanoate CAS Name: octadecanoic acid [4,4-diethoxy-2-(hydroxymethyl)butyl] ester IUPAC Name: [4,4-diethoxy-2-(hydroxymethyl)butyl] octadecanoate Traditional Name: stearic acid (4,4-diethoxy-2-methylol-butyl) ester Formula: C27H54O5 MolecularWeight: 458.71466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H54O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(29)32-24-25(23-28)22-27(30-5-2)31-6-3/h25,27-28H,4-24H2,1-3H3