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

Systemtic Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; octanoic acid Openeye Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; octanoic acid CAS Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; octanoic acid IUPAC Name: decanoic acid; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; octanoic acid Traditional Name: capric acid; caprylic acid; 2-ethyl-2-methylol-propane-1,3-diol Formula: C24H50O7 MolecularWeight: 450.6496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H20O2.C8H16O2.C6H14O3/c1-2-3-4-5-6-7-8-9-10(11)12;1-2-3-4-5-6-7-8(9)10;1-2-6(3-7,4-8)5-9/h2-9H2,1H3,(H,11,12);2-7H2,1H3,(H,9,10);7-9H,2-5H2,1H3