1,1,1-tris(fluoranyl)dodecan-3-ylsulfanylbenzene

Systemtic Name: 1,1,1-tris(fluoranyl)dodecan-3-ylsulfanylbenzene Openeye Name: 1-(2,2,2-trifluoroethyl)decylsulfanylbenzene CAS Name: (1,1,1-trifluorododecan-3-ylthio)benzene IUPAC Name: 1,1,1-trifluorododecan-3-ylsulfanylbenzene Traditional Name: [1-(2,2,2-trifluoroethyl)decylthio]benzene Formula: C18H27F3S MolecularWeight: 332.46719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CC(F)(F)F)SC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCC(CC(F)(F)F)SC1=CC=CC=C1

InChI

InChI=1S/C18H27F3S/c1-2-3-4-5-6-7-9-14-17(15-18(19,20)21)22-16-12-10-8-11-13-16/h8,10-13,17H,2-7,9,14-15H2,1H3