Cas no 898748-57-7 (2,4-DICHLORO-6-NITROBENZOTHIAZOLE)
898748-57-7 structure
Product Name:2,4-DICHLORO-6-NITROBENZOTHIAZOLE
CAS No:898748-57-7
MF:C7H2Cl2N2O2S
MW:249.073977947235
CID:890405
PubChem ID:24728964
Update Time:2025-04-19
2,4-DICHLORO-6-NITROBENZOTHIAZOLE Chemical and Physical Properties
Names and Identifiers
-
- 2,4-DICHLORO-6-NITROBENZOTHIAZOLE
- 898748-57-7
- 2,4-dichloro-6-nitro-1,3-benzothiazole
-
- Inchi： 1S/C7H2Cl2N2O2S/c8-4-1-3(11(12)13)2-5-6(4)10-7(9)14-5/h1-2H
- InChI Key： OORXGIZVASUBRI-UHFFFAOYSA-N
- SMILES： ClC1=CC(=CC2=C1N=C(S2)Cl)[N+](=O)[O-]
Computed Properties
- Exact Mass: 247.921
- Monoisotopic Mass: 247.921
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 250
- 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: 3.9
- Topological Polar Surface Area: 87A^2
2,4-DICHLORO-6-NITROBENZOTHIAZOLE Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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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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