117271-77-9
CYCLOBIS(PARAQUAT-1,4-PHENYLENE) TETRAKIS(HEXAFLUOROPHOSPHATE)
NameCYCLOBIS(PARAQUAT-1,4-PHENYLENE) TETRAKIS(HEXAFLUOROPHOSPHATE)
FormulaC36 H32 N4 . 4 F6 P
1Identification
【Name】
CYCLOBIS(PARAQUAT-1,4-PHENYLENE) TETRAKIS(HEXAFLUOROPHOSPHATE)
【CAS】
【MDL】
MFCD08276322
【English Synonyms】
【Formula】
C36 H32 N4 . 4 F6 P
【MolWeight】
1100.52
【Inchi】
InChI=1S/C36H32N4.4F6P/c1-2-30-4-3-29(1)25-37-17-9-33(10-18-37)35-13-21-39(22-14-35)27-31-5-7-32(8-6-31)28-40-23-15-36(16-24-40)34-11-19-38(26-30)20-12-34;4*1-7(2,3,4,5)6/h1-24H,25-28H2;;;;/q+4;4*-1
【InChIKey】
InChIKey=ORRBEFRZPYDCAJ-UHFFFAOYSA-N
【SMILES】
c1cc2ccc1C[n+]3ccc(cc3)-c4cc[n+](cc4)Cc5ccc(cc5)C[n+]6ccc(cc6)-c7cc[n+](cc7)C2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F
【MOL File】
CYCLOBIS(PARAQUAT-1,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CYCLOBIS(PARAQUAT-1,4-PHENYLENE) TETRAKIS(HEXAFLUOROPHOSPHATE).cml