2-butyl-4,4-dimethyl-2-pentyl-pentane-1,3-diol

Systemtic Name: 2-butyl-4,4-dimethyl-2-pentyl-pentane-1,3-diol Openeye Name: 2-butyl-4,4-dimethyl-2-pentyl-pentane-1,3-diol CAS Name: 2-butyl-4,4-dimethyl-2-pentylpentane-1,3-diol IUPAC Name: 2-butyl-4,4-dimethyl-2-pentylpentane-1,3-diol Traditional Name: 2-amyl-2-butyl-4,4-dimethyl-pentane-1,3-diol Formula: C16H34O2 MolecularWeight: 258.43996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC)(CO)C(C(C)(C)C)O

Isomeric SMILES

CCCCCC(CCCC)(CO)C(C(C)(C)C)O

InChI

InChI=1S/C16H34O2/c1-6-8-10-12-16(13-17,11-9-7-2)14(18)15(3,4)5/h14,17-18H,6-13H2,1-5H3