Cas no 654069-86-0 (Quinolinium, 7-chloro-1-ethyl-2-methyl-, iodide)
654069-86-0 structure
Product Name:Quinolinium, 7-chloro-1-ethyl-2-methyl-, iodide
CAS No:654069-86-0
MF:C12H13ClIN
MW:333.595794439316
CID:399362
PubChem ID:69855849
Update Time:2025-04-19
Quinolinium, 7-chloro-1-ethyl-2-methyl-, iodide Chemical and Physical Properties
Names and Identifiers
-
- Quinolinium, 7-chloro-1-ethyl-2-methyl-, iodide
- 7-chloro-1-ethyl-2-methylquinolin-1-ium,iodide
- 654069-86-0
- 7-Chloro-1-ethyl-2-methylquinolin-1-ium iodide
- SCHEMBL6660743
- DTXSID60741427
-
- Inchi： 1S/C12H13ClN.HI/c1-3-14-9(2)4-5-10-6-7-11(13)8-12(10)14;/h4-8H,3H2,1-2H3;1H/q+1;/p-1
- InChI Key： VOSAKFGTHSFIOA-UHFFFAOYSA-M
- SMILES： [I-].ClC1C=CC2=CC=C(C)[N+](CC)=C2C=1
Computed Properties
- Exact Mass: 319.876
- Monoisotopic Mass: 332.97812g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 195
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 3.9?2
Experimental Properties
- PSA: 3.88
Quinolinium, 7-chloro-1-ethyl-2-methyl-, iodide Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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