2-[[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; dodecanoic acid; heptanoic acid; octanoic acid

Systemtic Name: 2-[[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; dodecanoic acid; heptanoic acid; octanoic acid Openeye Name: dodecanoic acid; heptanoic acid; 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; octanoic acid CAS Name: dodecanoic acid; heptanoic acid; 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; octanoic acid IUPAC Name: dodecanoic acid; heptanoic acid; 2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol; octanoic acid Traditional Name: caprylic acid; enanthic acid; 2-[(3-hydroxy-2,2-dimethylol-propoxy)methyl]-2-methylol-propane-1,3-diol; lauric acid Formula: C37H76O13 MolecularWeight: 728.99154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O

Isomeric SMILES

CCCCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O

InChI

InChI=1S/C12H24O2.C10H22O7.C8H16O2.C7H14O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;11-1-9(2-12,3-13)7-17-8-10(4-14,5-15)6-16;1-2-3-4-5-6-7-8(9)10;1-2-3-4-5-6-7(8)9/h2-11H2,1H3,(H,13,14);11-16H,1-8H2;2-7H2,1H3,(H,9,10);2-6H2,1H3,(H,8,9)