3-[4-(trifluoromethyl)phenyl]sulfanylpropanoic acid

Systemtic Name: 3-[4-(trifluoromethyl)phenyl]sulfanylpropanoic acid Openeye Name: 3-[4-(trifluoromethyl)phenyl]sulfanylpropanoic acid CAS Name: 3-[[4-(trifluoromethyl)phenyl]thio]propanoic acid IUPAC Name: 3-[4-(trifluoromethyl)phenyl]sulfanylpropanoic acid Traditional Name: 3-[[4-(trifluoromethyl)phenyl]thio]propionic acid Formula: C10H9F3O2S MolecularWeight: 250.23747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)SCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)SCCC(=O)O

InChI

InChI=1S/C10H9F3O2S/c11-10(12,13)7-1-3-8(4-2-7)16-6-5-9(14)15/h1-4H,5-6H2,(H,14,15)