2-(trifluoromethylsulfonyl)propanoic acid

Systemtic Name: 2-(trifluoromethylsulfonyl)propanoic acid Openeye Name: 2-(trifluoromethylsulfonyl)propanoic acid CAS Name: 2-(trifluoromethylsulfonyl)propanoic acid IUPAC Name: 2-(trifluoromethylsulfonyl)propanoic acid Traditional Name: 2-triflylpropionic acid Formula: C4H5F3O4S MolecularWeight: 206.14031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C(=O)O)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C4H5F3O4S/c1-2(3(8)9)12(10,11)4(5,6)7/h2H,1H3,(H,8,9)