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

Systemtic Name: 2-hexyl-4,4-dimethyl-2-pentyl-pentane-1,3-diol Openeye Name: 2-hexyl-4,4-dimethyl-2-pentyl-pentane-1,3-diol CAS Name: 2-hexyl-4,4-dimethyl-2-pentylpentane-1,3-diol IUPAC Name: 2-hexyl-4,4-dimethyl-2-pentylpentane-1,3-diol Traditional Name: 2-amyl-2-hexyl-4,4-dimethyl-pentane-1,3-diol Formula: C18H38O2 MolecularWeight: 286.49312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCC)(CO)C(C(C)(C)C)O

Isomeric SMILES

CCCCCCC(CCCCC)(CO)C(C(C)(C)C)O

InChI

InChI=1S/C18H38O2/c1-6-8-10-12-14-18(15-19,13-11-9-7-2)16(20)17(3,4)5/h16,19-20H,6-15H2,1-5H3