2,2-bis(hydroxymethyl)heptanoic acid

Systemtic Name: 2,2-bis(hydroxymethyl)heptanoic acid Openeye Name: 2,2-bis(hydroxymethyl)heptanoic acid CAS Name: 2,2-bis(hydroxymethyl)heptanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)heptanoic acid Traditional Name: 2,2-dimethylolenanthic acid Formula: C9H18O4 MolecularWeight: 190.23682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CO)(CO)C(=O)O

Isomeric SMILES

CCCCCC(CO)(CO)C(=O)O

InChI

InChI=1S/C9H18O4/c1-2-3-4-5-9(6-10,7-11)8(12)13/h10-11H,2-7H2,1H3,(H,12,13)