3-Methyl-2-[(1E)-3-{1-[3-(Trimethylammonio)Propyl]-4(1H)-Pyridinylidene}-1-Propen-1-Yl]-1,3-Benzothiazol-3-Ium Diiodide
[CAS# 173357-16-9]

Identification

• Name: 3-Methyl-2-[(1E)-3-{1-[3-(Trimethylammonio)Propyl]-4(1H)-Pyridinylidene}-1-Propen-1-Yl]-1,3-Benzothiazol-3-Ium Diiodide
• Synonyms: 3-methyl-2-{(E)-3-[1-[3-(trimethylammonio)propyl]-4(1H)-pyridinylidene]-1-propenyl}-1,3-benzothiazol-3-ium diiodide; Benzothiazolium, 3-methyl-2-[3-[1-[3-(trimethylammonio)propyl]-4(1H)-pyridinylidene]-1-propenyl]-, diiodide (9CI); ; BO-PRO 3
• Molecular Formula: C₂₂H₂₉I₂N₃S
• Molecular Weight: 621.36
• CAS Registry Number: 173357-16-9
• SMILES: C[n+]1c2ccccc2sc1C=CC=C3C=CN(C=C3)CCC[N+](C)(C)C.[I-].[I-]
• InChI: 1S/C22H29N3S.2HI/c1-23-20-10-5-6-11-21(20)26-22(23)12-7-9-19-13-16-24(17-14-19)15-8-18-25(2,3)4;;/h5-7,9-14,16-17H,8,15,18H2,1-4H3;2*1H/q+2;;/p-2
• InChIKey: AZQGBYOYQBPRGT-UHFFFAOYSA-L

Properties

• Refractive index: (Cal.)