Cas no 850180-81-3 (2(1H)-PYRIDINONE, 3-BROMO-4-CHLORO-5-NITRO-)
850180-81-3 structure
Product Name:2(1H)-PYRIDINONE, 3-BROMO-4-CHLORO-5-NITRO-
CAS No:850180-81-3
MF:C5H2BrClN2O3
MW:253.437979221344
CID:3238061
PubChem ID:58792227
Update Time:2025-04-21
2(1H)-PYRIDINONE, 3-BROMO-4-CHLORO-5-NITRO- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-PYRIDINONE, 3-BROMO-4-CHLORO-5-NITRO-
- SCHEMBL13458098
- SCHEMBL8289833
- DB-378775
- SCHEMBL5250855
- DTXSID101269199
- OSXUCEKFUVEIOJ-UHFFFAOYSA-N
- 850180-81-3
- 3-Bromo-4-chloro-5-nitro-2(1H)-pyridinone
- 3-Bromo-4-chloro-5-nitro-2-pyridone
-
- Inchi： 1S/C5H2BrClN2O3/c6-3-4(7)2(9(11)12)1-8-5(3)10/h1H,(H,8,10)
- InChI Key： OSXUCEKFUVEIOJ-UHFFFAOYSA-N
- SMILES： BrC1C(NC=C(C=1Cl)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 251.89373Da
- Monoisotopic Mass: 251.89373Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 317
- 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: 1
- Topological Polar Surface Area: 74.9?2
2(1H)-PYRIDINONE, 3-BROMO-4-CHLORO-5-NITRO- 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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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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4. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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