C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(C(F)(F)S(=O)(=O)[O-])O
Name: 1,1-difluoro-2-hydroxyethanesulfonate;triphenylsulfanium
SMILES: C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(C(F)(F)S(=O)(=O)[O-])O

Molecular Processing

Molecular formula
C20H18F2O4S2
Molecular weight
424.49
Exact mass
424.0615
XLogP
3.9
TPSA
77.43
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.1
Molar refractivity
103.22

Supplementary Information

InChIKey: NQECNQVTAPRTRZ-UHFFFAOYSA-M
Synonyms
SCHEMBL501411triphenylsulfonium 1,1-difluoro-2-hydroxyethanesulfonateNQECNQVTAPRTRZ-UHFFFAOYSA-Mtriphenylsulfonium 1,1-difluoro-2-hydroxy-ethanesulfonatetriphenylsulfonium 2-hydroxy-1,1-difluoroethanesulfonate
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Involved in 23 reactions→

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