3,3-dimethyl-1-sulfanyl-heptan-2-ol

Systemtic Name: 3,3-dimethyl-1-sulfanyl-heptan-2-ol Openeye Name: 3,3-dimethyl-1-sulfanyl-heptan-2-ol CAS Name: 1-mercapto-3,3-dimethyl-2-heptanol IUPAC Name: 3,3-dimethyl-1-sulfanylheptan-2-ol Traditional Name: 1-mercapto-3,3-dimethyl-heptan-2-ol Formula: C9H20OS MolecularWeight: 176.3195

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(CS)O

Isomeric SMILES

CCCCC(C)(C)C(CS)O

InChI

InChI=1S/C9H20OS/c1-4-5-6-9(2,3)8(10)7-11/h8,10-11H,4-7H2,1-3H3