Cas no 354527-54-1 (Pyridine, 2-nitro-, hydrate)
Pyridine, 2-nitro-, hydrate structure
Product Name:Pyridine, 2-nitro-, hydrate
CAS No:354527-54-1
MF:C5H6N2O3
MW:142.1127409935
CID:2847865
Update Time:2023-08-10
Pyridine, 2-nitro-, hydrate Chemical and Physical Properties
Names and Identifiers
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- 2-Nitropyridine--water (1/1)
- Pyridine, 2-nitro-, hydrate
-
- Inchi: 1S/C5H4N2O2.H2O/c8-7(9)5-3-1-2-4-6-5;/h1-4H;1H2
- InChI Key: KQZNIBDRFBZVTA-UHFFFAOYSA-N
- SMILES: [O-][N+](C1C=CC=CN=1)=O.O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 110
- Topological Polar Surface Area: 59.7
Pyridine, 2-nitro-, hydrate Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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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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5. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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