1,1,1-tris(fluoranyl)-4-phenylsulfanyl-dodecane-2,2-diol

Systemtic Name: 1,1,1-tris(fluoranyl)-4-phenylsulfanyl-dodecane-2,2-diol Openeye Name: 1,1,1-trifluoro-4-phenylsulfanyl-dodecane-2,2-diol CAS Name: 1,1,1-trifluoro-4-(phenylthio)dodecane-2,2-diol IUPAC Name: 1,1,1-trifluoro-4-phenylsulfanyldodecane-2,2-diol Traditional Name: 1,1,1-trifluoro-4-(phenylthio)dodecane-2,2-diol Formula: C18H27F3O2S MolecularWeight: 364.46599

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(C(F)(F)F)(O)O)SC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCC(CC(C(F)(F)F)(O)O)SC1=CC=CC=C1

InChI

InChI=1S/C18H27F3O2S/c1-2-3-4-5-6-8-13-16(14-17(22,23)18(19,20)21)24-15-11-9-7-10-12-15/h7,9-12,16,22-23H,2-6,8,13-14H2,1H3