151648-23-6
4-(2-(2-CHLORO-3-[2-(1-ETHYL-1,4-DIHYDRO-4-QUINOLINYLIDEN)ETHYLIDENE]-1-CYCLOHEXENYL)-1-ETHENYL)-1-ETHYLQUINOLINIUM BROMIDE
Name4-(2-(2-CHLORO-3-[2-(1-ETHYL-1,4-DIHYDRO-4-QUINOLINYLIDEN)ETHYLIDENE]-1-CYCLOHEXENYL)-1-ETHENYL)-1-ETHYLQUINOLINIUM BROMIDE
FormulaC32 H32 Cl N2 . Br
1Identification
【Name】
4-(2-(2-CHLORO-3-[2-(1-ETHYL-1,4-DIHYDRO-4-QUINOLINYLIDEN)ETHYLIDENE]-1-CYCLOHEXENYL)-1-ETHENYL)-1-ETHYLQUINOLINIUM BROMIDE
【CAS】
【MDL】
MFCD07433663
【English Synonyms】
【Formula】
C32 H32 Cl N2 . Br
【MolWeight】
559.976
【Inchi】
InChI=1S/C32H32ClN2.BrH/c1-3-34-22-20-24(28-12-5-7-14-30(28)34)16-18-26-10-9-11-27(32(26)33)19-17-25-21-23-35(4-2)31-15-8-6-13-29(25)31;/h5-8,12-23H,3-4,9-11H2,1-2H3;1H/q+1;/p-1
【InChIKey】
InChIKey=MSLSNOSAXCJGOX-UHFFFAOYSA-M
【SMILES】
CC[n+]1ccc(c2c1cccc2)/C=C/C3=C(/C(=C/C=C\4/C=CN(c5c4cccc5)CC)/CCC3)Cl.[Br-]
【MOL File】
4-(2-(2-CHLORO-3-[2-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:8.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(2-CHLORO-3-[2-(1-ETHYL-1,4-DIHYDRO-4-QUINOLINYLIDEN)ETHYLIDENE]-1-CYCLOHEXENYL)-1-ETHENYL)-1-ETHYLQUINOLINIUM BROMIDE.cml