6-[3-(hydroxymethyl)phenyl]hexanoic acid

Systemtic Name: 6-[3-(hydroxymethyl)phenyl]hexanoic acid Openeye Name: 6-[3-(hydroxymethyl)phenyl]hexanoic acid CAS Name: 6-[3-(hydroxymethyl)phenyl]hexanoic acid IUPAC Name: 6-[3-(hydroxymethyl)phenyl]hexanoic acid Traditional Name: 6-(3-methylolphenyl)hexanoic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CO)CCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CO)CCCCCC(=O)O

InChI

InChI=1S/C13H18O3/c14-10-12-7-4-6-11(9-12)5-2-1-3-8-13(15)16/h4,6-7,9,14H,1-3,5,8,10H2,(H,15,16)