102584-24-7
1,1'-(P-PHENYLENEDIMETHYLENE)BIS(4-(3-HYDROXYPROPYL)PYRIDINIUM BROMIDE)
Name1,1'-(P-PHENYLENEDIMETHYLENE)BIS(4-(3-HYDROXYPROPYL)PYRIDINIUM BROMIDE)
FormulaC24 H30 N2 O2 . 2 Br
1Identification
【Name】
1,1'-(P-PHENYLENEDIMETHYLENE)BIS(4-(3-HYDROXYPROPYL)PYRIDINIUM BROMIDE)
【CAS】
【MDL】
MFCD01690917
【English Synonyms】
【Formula】
C24 H30 N2 O2 . 2 Br
【MolWeight】
538.321
【Inchi】
InChI=1S/C24H30N2O2.2BrH/c27-17-1-3-21-9-13-25(14-10-21)19-23-5-7-24(8-6-23)20-26-15-11-22(12-16-26)4-2-18-28;;/h5-16,27-28H,1-4,17-20H2;2*1H/q+2;;/p-2
【InChIKey】
InChIKey=GTKJZIVBDJBGEE-UHFFFAOYSA-L
【SMILES】
c1cc(ccc1C[n+]2ccc(cc2)CCCO)C[n+]3ccc(cc3)CCCO.[Br-].[Br-]
【MOL File】
1,1'-(P-PHENYLENEDIM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,1'-(P-PHENYLENEDIMETHYLENE)BIS(4-(3-HYDROXYPROPYL)PYRIDINIUM BROMIDE).cml