346621-41-8
4,4',4'',4'''-(2,3,4,5-THIOPHENTETRAYL)TETRAKIS(1-ETHYL-TETRAKIS-(1-)PYRIDINIUMTETRAFLUOROBORATE)
Name4,4',4'',4'''-(2,3,4,5-THIOPHENTETRAYL)TETRAKIS(1-ETHYL-TETRAKIS-(1-)PYRIDINIUMTETRAFLUOROBORATE)
FormulaC28 H28 N4 S . 4 B F4
1Identification
【Name】
4,4',4'',4'''-(2,3,4,5-THIOPHENTETRAYL)TETRAKIS(1-ETHYL-TETRAKIS-(1-)PYRIDINIUMTETRAFLUOROBORATE)
【CAS】
【MDL】
MFCD03411763
【English Synonyms】
【Formula】
C28 H28 N4 S . 4 B F4
【MolWeight】
799.835
【Inchi】
InChI=1S/C28H28N4S.4BF4/c1-29-13-5-21(6-14-29)25-26(22-7-15-30(2)16-8-22)28(24-11-19-32(4)20-12-24)33-27(25)23-9-17-31(3)18-10-23;4*2-1(3,4)5/h5-20H,1-4H3;;;;/q+4;4*-1
【InChIKey】
InChIKey=KCYONTPPTBIONR-UHFFFAOYSA-N
【SMILES】
[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.C[n+]1ccc(cc1)c2c(c(sc2c3cc[n+](cc3)C)c4cc[n+](cc4)C)c5cc[n+](cc5)C
【MOL File】
4,4',4'',4'''-(2,3,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,4',4'',4'''-(2,3,4,5-THIOPHENTETRAYL)TETRAKIS(1-ETHYL-TETRAKIS-(1-)PYRIDINIUMTETRAFLUOROBORATE).cml