[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] 3,5,5-trimethylhexanoate

Systemtic Name: [2,2-bis(hydroxymethyl)-3-oxidanyl-propyl] 3,5,5-trimethylhexanoate Openeye Name: [3-hydroxy-2,2-bis(hydroxymethyl)propyl] 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid [3-hydroxy-2,2-bis(hydroxymethyl)propyl] ester IUPAC Name: [3-hydroxy-2,2-bis(hydroxymethyl)propyl] 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid (3-hydroxy-2,2-dimethylol-propyl) ester Formula: C14H28O5 MolecularWeight: 276.36912

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(CO)(CO)CO)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)OCC(CO)(CO)CO)CC(C)(C)C

InChI

InChI=1S/C14H28O5/c1-11(6-13(2,3)4)5-12(18)19-10-14(7-15,8-16)9-17/h11,15-17H,5-10H2,1-4H3