Cas no 89167-37-3 (Pyridine,4-chloro-3-nitro-, 1-oxide)
89167-37-3 structure
Product Name:Pyridine,4-chloro-3-nitro-, 1-oxide
CAS No:89167-37-3
MF:C5H3ClN2O3
MW:174.541919946671
CID:733853
PubChem ID:273122
Update Time:2025-04-19
Pyridine,4-chloro-3-nitro-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- Pyridine,4-chloro-3-nitro-, 1-oxide
- 4-chloro-3-nitro-1-oxidopyridin-1-ium
- 3-Nitro-4-chlor-pyridin-1-oxid
- 4-Chlor-3-nitro-pyridin-1-oxid
- 4-Chlor-3-nitro-pyridin-N-oxid
- 4-Chlor-3-nitro-pyridin-N-oxyd
- 4-chloro-3-nitro-pyridine-1-oxide
- 89167-37-3
- SCHEMBL7034289
- 4-chloro-3-nitropyridine 1-oxide
- NSC-118084
- DTXSID90297785
- NSC118084
-
- Inchi： 1S/C5H3ClN2O3/c6-4-1-2-7(9)3-5(4)8(10)11/h1-3H
- InChI Key： IGLDADAPDSPFDD-UHFFFAOYSA-N
- SMILES： ClC1C=C[N+](=CC=1[N+](=O)[O-])[O-]
Computed Properties
- Exact Mass: 173.98300
- Monoisotopic Mass: 173.9832197g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 160
- 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: 0.3
- Topological Polar Surface Area: 71.3?2
Experimental Properties
- PSA: 71.28000
- LogP: 2.19990
Pyridine,4-chloro-3-nitro-, 1-oxide Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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