Cas no 1211517-54-2 (2-Chloro-5-nitro-3-pyridinylethanone)
1211517-54-2 structure
Product Name:2-Chloro-5-nitro-3-pyridinylethanone
CAS No:1211517-54-2
MF:C7H5ClN2O3
MW:200.57920050621
CID:3164876
PubChem ID:53445988
Update Time:2025-04-21
2-Chloro-5-nitro-3-pyridinylethanone Chemical and Physical Properties
Names and Identifiers
-
- 2-Chloro-5-nitro-3-pyridinylethanone
- 1211517-54-2
- 1-(2-chloro-5-nitropyridin-3-yl)ethanone
- AKOS015851071
- SCHEMBL17080674
-
- Inchi： 1S/C7H5ClN2O3/c1-4(11)6-2-5(10(12)13)3-9-7(6)8/h2-3H,1H3
- InChI Key： LBSOAPIYGVMPBR-UHFFFAOYSA-N
- SMILES： ClC1C(C(C)=O)=CC(=CN=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 199.9988697Da
- Monoisotopic Mass: 199.9988697Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 228
- 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: 1.3
- Topological Polar Surface Area: 75.8?2
2-Chloro-5-nitro-3-pyridinylethanone Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
1211517-54-2 (2-Chloro-5-nitro-3-pyridinylethanone) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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