methyl 2,2-dimethyl-5-sulfanyl-pentanoate

Systemtic Name: methyl 2,2-dimethyl-5-sulfanyl-pentanoate Openeye Name: methyl 2,2-dimethyl-5-sulfanyl-pentanoate CAS Name: 5-mercapto-2,2-dimethylpentanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-5-sulfanylpentanoate Traditional Name: 5-mercapto-2,2-dimethyl-valeric acid methyl ester Formula: C8H16O2S MolecularWeight: 176.27644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCS)C(=O)OC

Isomeric SMILES

CC(C)(CCCS)C(=O)OC

InChI

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