2-(3,3-dimethylbutylsulfanyl)propanoic acid

Systemtic Name: 2-(3,3-dimethylbutylsulfanyl)propanoic acid Openeye Name: 2-(3,3-dimethylbutylsulfanyl)propanoic acid CAS Name: 2-(3,3-dimethylbutylthio)propanoic acid IUPAC Name: 2-(3,3-dimethylbutylsulfanyl)propanoic acid Traditional Name: 2-(3,3-dimethylbutylthio)propionic acid Formula: C9H18O2S MolecularWeight: 190.30302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCCC(C)(C)C

Isomeric SMILES

CC(C(=O)O)SCCC(C)(C)C

InChI

InChI=1S/C9H18O2S/c1-7(8(10)11)12-6-5-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11)