hexyl 2-sulfanylethanoate

Systemtic Name: hexyl 2-sulfanylethanoate Openeye Name: hexyl 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid hexyl ester IUPAC Name: hexyl 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid hexyl ester Formula: C8H16O2S MolecularWeight: 176.27644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CS

Isomeric SMILES

CCCCCCOC(=O)CS

InChI

InChI=1S/C8H16O2S/c1-2-3-4-5-6-10-8(9)7-11/h11H,2-7H2,1H3