5,5,5-tris(fluoranyl)-4-phenyl-4-(trifluoromethyl)pentane-1-sulfonic acid

Systemtic Name: 5,5,5-tris(fluoranyl)-4-phenyl-4-(trifluoromethyl)pentane-1-sulfonic acid Openeye Name: 5,5,5-trifluoro-4-phenyl-4-(trifluoromethyl)pentane-1-sulfonic acid CAS Name: 5,5,5-trifluoro-4-phenyl-4-(trifluoromethyl)-1-pentanesulfonic acid IUPAC Name: 5,5,5-trifluoro-4-phenyl-4-(trifluoromethyl)pentane-1-sulfonic acid Traditional Name: 5,5,5-trifluoro-4-phenyl-4-(trifluoromethyl)pentane-1-sulfonic acid Formula: C12H12F6O3S MolecularWeight: 350.277299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCS(=O)(=O)O)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(CCCS(=O)(=O)O)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H12F6O3S/c13-11(14,15)10(12(16,17)18,7-4-8-22(19,20)21)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,19,20,21)