3-(hydroxymethyl)-5-methyl-octanoic acid

Systemtic Name: 3-(hydroxymethyl)-5-methyl-octanoic acid Openeye Name: 3-(hydroxymethyl)-5-methyl-octanoic acid CAS Name: 3-(hydroxymethyl)-5-methyloctanoic acid IUPAC Name: 3-(hydroxymethyl)-5-methyloctanoic acid Traditional Name: 5-methyl-3-methylol-caprylic acid Formula: C10H20O3 MolecularWeight: 188.264

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(CC(=O)O)CO

Isomeric SMILES

CCCC(C)CC(CC(=O)O)CO

InChI

InChI=1S/C10H20O3/c1-3-4-8(2)5-9(7-11)6-10(12)13/h8-9,11H,3-7H2,1-2H3,(H,12,13)