2,2-bis(hydroxymethyl)butyl docosanoate

Systemtic Name: 2,2-bis(hydroxymethyl)butyl docosanoate Openeye Name: 2,2-bis(hydroxymethyl)butyl docosanoate CAS Name: docosanoic acid 2,2-bis(hydroxymethyl)butyl ester IUPAC Name: 2,2-bis(hydroxymethyl)butyl docosanoate Traditional Name: behenic acid 2,2-dimethylolbutyl ester Formula: C28H56O4 MolecularWeight: 456.74184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)CO

InChI

InChI=1S/C28H56O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(31)32-26-28(4-2,24-29)25-30/h29-30H,3-26H2,1-2H3