3-(2-ethylhexylsulfanyl)propanoic acid

Systemtic Name: 3-(2-ethylhexylsulfanyl)propanoic acid Openeye Name: 3-(2-ethylhexylsulfanyl)propanoic acid CAS Name: 3-(2-ethylhexylthio)propanoic acid IUPAC Name: 3-(2-ethylhexylsulfanyl)propanoic acid Traditional Name: 3-(2-ethylhexylthio)propionic acid Formula: C11H22O2S MolecularWeight: 218.35618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CSCCC(=O)O

Isomeric SMILES

CCCCC(CC)CSCCC(=O)O

InChI

InChI=1S/C11H22O2S/c1-3-5-6-10(4-2)9-14-8-7-11(12)13/h10H,3-9H2,1-2H3,(H,12,13)