2,2-bis(hydroxymethyl)hexyl (E)-octadec-9-enoate

Systemtic Name: 2,2-bis(hydroxymethyl)hexyl (E)-octadec-9-enoate Openeye Name: 2,2-bis(hydroxymethyl)hexyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 2,2-bis(hydroxymethyl)hexyl ester IUPAC Name: 2,2-bis(hydroxymethyl)hexyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 2,2-dimethylolhexyl ester Formula: C26H50O4 MolecularWeight: 426.6728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CCCC)(CO)CO

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(CCCC)(CO)CO

InChI

InChI=1S/C26H50O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-24-26(22-27,23-28)21-6-4-2/h12-13,27-28H,3-11,14-24H2,1-2H3/b13-12+