Cas no 2423-68-9 (Quinoline, 2-chloro-, 1-oxide)
Quinoline, 2-chloro-, 1-oxide structure
Product Name:Quinoline, 2-chloro-, 1-oxide
CAS No:2423-68-9
MF:C9H6ClNO
MW:179.603041172028
CID:1416887
PubChem ID:12245212
Update Time:2025-04-20
Quinoline, 2-chloro-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- Quinoline, 2-chloro-, 1-oxide
- 2-chloro-1-oxidoquinolin-1-ium
- 2423-68-9
- SCHEMBL11710301
- 2-chloro-quinoline-N-oxide
- SSVVALKTXQOZNA-UHFFFAOYSA-N
- DTXSID20482162
- 2-chloroquinoline-N-oxide
-
- Inchi: 1S/C9H6ClNO/c10-9-6-5-7-3-1-2-4-8(7)11(9)12/h1-6H
- InChI Key: SSVVALKTXQOZNA-UHFFFAOYSA-N
- SMILES: ClC1=CC=C2C=CC=CC2=[N+]1[O-]
Computed Properties
- Exact Mass: 179.01388
- Monoisotopic Mass: 179.0137915g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 165
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 25.5?2
Experimental Properties
- PSA: 26.94
Quinoline, 2-chloro-, 1-oxide Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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