decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol

Systemtic Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol Openeye Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol CAS Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol Traditional Name: capric acid; 2-ethyl-2-methylol-propane-1,3-diol Formula: C16H34O5 MolecularWeight: 306.43816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)O.CCC(CO)(CO)CO

Isomeric SMILES

CCCCCCCCCC(=O)O.CCC(CO)(CO)CO

InChI

InChI=1S/C10H20O2.C6H14O3/c1-2-3-4-5-6-7-8-9-10(11)12;1-2-6(3-7,4-8)5-9/h2-9H2,1H3,(H,11,12);7-9H,2-5H2,1H3