{[(Trifluoromethyl)thio]ethynyl}benzene structure

{[(Trifluoromethyl)thio]ethynyl}benzene

2-(trifluoromethylsulfanyl)ethynylbenzene

Also Known As: {[(trifluoromethyl)thio]ethynyl}benzene|Trifluoromethylthioethynylbenzene|2-(trifluoromethylsulfanyl)ethynylbenzene|Phenylethynyl(trifluoromethyl) sulfide|1-(Trifluoromethylthio)-2-phenylethyne|1-Phenyl-2-(trifluoromethylthio)ethyne|(Phenylethynyl)(trifluoromethyl) sulfide|[[(Trifluoromethyl)thio]ethynyl]benzene|[2-[(Trifluoromethyl)thio]ethynyl]benzene|{[(Trifluoromethyl)sulfanyl]ethynyl}benzene|benzene, [[(trifluoromethyl)thio]ethynyl]-|{2-[(trifluoromethyl)sulfanyl]ethynyl}benzene|J3.101.869B

CAS: 2002-89-3
Molecular Formula C9H5F3S
Molecular Weight 202.00641 g/mol
LogP 4.2
Topological Polar Surface Area 25.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 202.00641
Monoisotopic Mass 202.00641
Heavy Atoms 13
Complexity 214.0

Chemical Identifiers

CAS Number 2002-89-3
SMILES C1=CC=C(C=C1)C#CSC(F)(F)F
InChIKey XMGKHJYSXPUKNW-UHFFFAOYSA-N

Product Overview

{[(Trifluoromethyl)thio]ethynyl}benzene (CAS 2002-89-3), with molecular formula C9H5F3S and molecular weight 202.00641 g/mol. IUPAC: 2-(trifluoromethylsulfanyl)ethynylbenzene.

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