Cas no 39844-54-7 (4,7-dichloro-1-methylquinolin-1-ium;iodide)
39844-54-7 structure
Product Name:4,7-dichloro-1-methylquinolin-1-ium;iodide
CAS No:39844-54-7
MF:C10H8Cl2IN
MW:339.987692832947
CID:924968
PubChem ID:10688482
Update Time:2025-04-19
4,7-dichloro-1-methylquinolin-1-ium;iodide Chemical and Physical Properties
Names and Identifiers
-
- 4,7-dichloro-1-methylquinolin-1-ium,iodide
- 4,7-dichloro-1-methylquinolin-1-ium
- iodide
- 39844-54-7
- NSC-505101
- SCHEMBL2551843
- AGN-PC-0N8VBX
- DTXSID30443567
- NSC505101
- 4,7-dichloro-1-methylquinolin-1-ium;iodide
-
- Inchi： 1S/C10H8Cl2N.HI/c1-13-5-4-9(12)8-3-2-7(11)6-10(8)13;/h2-6H,1H3;1H/q+1;/p-1
- InChI Key： SGONXZRSLCMWGK-UHFFFAOYSA-M
- SMILES： [I-].ClC1C=C[N+](C)=C2C=C(C=CC2=1)Cl
Computed Properties
- Exact Mass: 213.01137
- Monoisotopic Mass: 338.90785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 186
- 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: 3.24
4,7-dichloro-1-methylquinolin-1-ium;iodide Related Literature
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Masrudin Md Yusoff,Muggundha Raoov,Noorfatimah Yahaya,Noorashikin Md Salleh RSC Adv., 2017,7, 35832-35844
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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