123489-64-5
4,4'-BIS(PYRROLIDINOACETYL)BIPHENYL DIMETHIOBROMIDE
Name4,4'-BIS(PYRROLIDINOACETYL)BIPHENYL DIMETHIOBROMIDE
FormulaC26 H34 N2 O2 . 2 Br
1Identification
【Name】
4,4'-BIS(PYRROLIDINOACETYL)BIPHENYL DIMETHIOBROMIDE
【CAS】
【MDL】
MFCD01687648
【English Synonyms】
【Formula】
C26 H34 N2 O2 . 2 Br
【MolWeight】
566.375
【Inchi】
InChI=1S/C26H34N2O2.2BrH/c1-27(15-3-4-16-27)19-25(29)23-11-7-21(8-12-23)22-9-13-24(14-10-22)26(30)20-28(2)17-5-6-18-28;;/h7-14H,3-6,15-20H2,1-2H3;2*1H/q+2;;/p-2
【InChIKey】
InChIKey=DYQNIBTUKRSYBL-UHFFFAOYSA-L
【SMILES】
C[N+]1(CCCC1)CC(=O)c2ccc(cc2)c3ccc(cc3)C(=O)C[N+]4(CCCC4)C.[Br-].[Br-]
【MOL File】
4,4'-BIS(PYRROLIDINO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,4'-BIS(PYRROLIDINOACETYL)BIPHENYL DIMETHIOBROMIDE.cml