Cas no 5000-22-6 (4-Pyridinol,2,3,5,6-tetrachloro-, sodium salt (1:1))
5000-22-6 structure
Product Name:4-Pyridinol,2,3,5,6-tetrachloro-, sodium salt (1:1)
CAS No:5000-22-6
MF:C5Cl4NNaO
MW:254.861368179321
CID:369157
PubChem ID:23678883
Update Time:2025-04-19
4-Pyridinol,2,3,5,6-tetrachloro-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyridinol,2,3,5,6-tetrachloro-, sodium salt (1:1)
- sodium 2,3,5,6-tetrachloropyridin-4-olate
- Sodium(2,3,5,6-tetrachloropyridine-4-olate)
- NS00045785
- 4-Pyridinol, 2,3,5,6-tetrachloro-, sodium salt (1:1)
- 4-Pyridinol, 2,3,5,6-tetrachloro-, sodium salt
- sodium;2,3,5,6-tetrachloropyridin-4-olate
- DTXSID3063673
- EINECS 225-664-0
- 5000-22-6
- 2,3,5,6-Tetrachloro-4-pyridinol sodium salt
-
- Inchi: 1S/C5HCl4NO.Na/c6-1-3(11)2(7)5(9)10-4(1)8;/h(H,10,11);/q;+1/p-1
- InChI Key: HBGFIKZGJDWPRO-UHFFFAOYSA-M
- SMILES: ClC1C(=NC(=C(C=1[O-])Cl)Cl)Cl.[Na+]
Computed Properties
- Exact Mass: 252.86300
- Monoisotopic Mass: 252.863169g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 137
- 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: 36?2
Experimental Properties
- PSA: 35.95000
- LogP: 3.83900
4-Pyridinol,2,3,5,6-tetrachloro-, sodium salt (1:1) Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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