3-(3-ethylhexan-3-yl)benzene-1,2-diol

Systemtic Name: 3-(3-ethylhexan-3-yl)benzene-1,2-diol Openeye Name: 3-(1,1-diethylbutyl)benzene-1,2-diol CAS Name: 3-(3-ethylhexan-3-yl)benzene-1,2-diol IUPAC Name: 3-(3-ethylhexan-3-yl)benzene-1,2-diol Traditional Name: 3-(1,1-diethylbutyl)pyrocatechol Formula: C14H22O2 MolecularWeight: 222.32328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(CC)C1=C(C(=CC=C1)O)O

Isomeric SMILES

CCCC(CC)(CC)C1=C(C(=CC=C1)O)O

InChI

InChI=1S/C14H22O2/c1-4-10-14(5-2,6-3)11-8-7-9-12(15)13(11)16/h7-9,15-16H,4-6,10H2,1-3H3