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

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; decanoic acid Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; decanoic acid CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; decanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; decanoic acid Traditional Name: capric acid; 2,2-dimethylolpropane-1,3-diol Formula: C85H172O20 MolecularWeight: 1514.26318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/8C10H20O2.C5H12O4/c8*1-2-3-4-5-6-7-8-9-10(11)12;6-1-5(2-7,3-8)4-9/h8*2-9H2,1H3,(H,11,12);6-9H,1-4H2