6,6,6-tris(fluoranyl)-5-phenyl-hexanoic acid

Systemtic Name: 6,6,6-tris(fluoranyl)-5-phenyl-hexanoic acid Openeye Name: 6,6,6-trifluoro-5-phenyl-hexanoic acid CAS Name: 6,6,6-trifluoro-5-phenylhexanoic acid IUPAC Name: 6,6,6-trifluoro-5-phenylhexanoic acid Traditional Name: 6,6,6-trifluoro-5-phenyl-hexanoic acid Formula: C12H13F3O2 MolecularWeight: 246.22563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3O2/c13-12(14,15)10(7-4-8-11(16)17)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,16,17)