Synonyms
CTK1G8962; AKOS015852954; AC1MC242; FT-0700859; SCHEMBL318231; TR-018537; YWVYZMVYXAVAKS-UHFFFAOYSA-N; Pyridinium triflate; ACMC-209ky5;
IUPAC Name
pyridin-1-ium;trifluoromethanesulfonate;
Molecular Weight
229.173g/mol
Molecular Formula
C6H6F3NO3S;
Canonical SMILES
C1=CC=[NH+]C=C1.C(F)(F)(F)S(=O)(=O)[O-];
InChI
InChI=1S/C5H5N.CHF3O3S/c1-2-4-6-5-3-1;2-1(3,4)8(5,6)7/h1-5H;(H,5,6,7);
InChI Key
YWVYZMVYXAVAKS-UHFFFAOYSA-N;
Complexity
176
Covalently-Bonded Unit Count
2
Exact Mass
229.002g/mol
H-Bond Acceptor
6
H-Bond Donor
1
Heavy Atom Count
14
Monoisotopic Mass
229.002g/mol
Topological Polar Surface Area
79.7A^2
