Cas no 113817-98-4 (1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide)
![1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide structure](https://ossimg.kuujia.com/scimg/114000/113817-98-4x500.png)
113817-98-4 structure
Product Name:1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide
CAS No:113817-98-4
MF:C16H30I2N2
MW:504.23174905777
CID:2611695
Update Time:2023-08-07
1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide Chemical and Physical Properties
Names and Identifiers
-
- 1-methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium,diiodide
- Piperidinium, 1,1'-(2-butyne-1,4-diyl)bis[1-methyl-, diiodide
- 1,1'-(But-2-yne-1,4-diyl)bis(1-methylpiperidin-1-ium) diiodide
- 1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide
-
- Inchi： 1S/C16H30N2.2HI/c1-17(11-5-3-6-12-17)15-9-10-16-18(2)13-7-4-8-14-18;;/h3-8,11-16H2,1-2H3;2*1H/q+2;;/p-2
- InChI Key： HKMSQMRUVFYFOI-UHFFFAOYSA-L
- SMILES： [I-].[I-].[N+]1(C)(CC#CC[N+]2(C)CCCCC2)CCCCC1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 292
- Topological Polar Surface Area: 0
1-Methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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