Cas no 79078-31-2 (Pyridine,2-bromomethyl-4-nitro-, 1-oxide (9CI))
79078-31-2 structure
Product Name:Pyridine,2-bromomethyl-4-nitro-, 1-oxide (9CI)
CAS No:79078-31-2
MF:C6H5BrN2O3
MW:233.019500494003
CID:554208
PubChem ID:53471962
Update Time:2025-04-19
Pyridine,2-bromomethyl-4-nitro-, 1-oxide (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pyridine,2-bromomethyl-4-nitro-, 1-oxide (9CI)
- 2-(bromomethyl)-4-nitro-1-oxidopyridin-1-ium
- 2-Bromomethyl-4-nitropyridine-1-oxide
- 2-(Brommethyl)-4-nitropyridin-1-oxid
- 2-(Bromométhyl)-4-nitropyridine-1-oxyde
- Pyridine, 2-(bromomethyl)-4-nitro-, 1-oxide
- T6NJ AO B1E DNW
- 79078-31-2
- 2-(Bromomethyl)-4-nitro-1-oxo-1lambda~5~-pyridine
- DTXSID20703804
- J-400280
-
- Inchi： 1S/C6H5BrN2O3/c7-4-6-3-5(9(11)12)1-2-8(6)10/h1-3H,4H2
- InChI Key： DAAPWWCPWYUAEI-UHFFFAOYSA-N
- SMILES： BrCC1C=C(C=C[N+]=1[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 231.94835g/mol
- Monoisotopic Mass: 231.94835g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 173
- 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
Pyridine,2-bromomethyl-4-nitro-, 1-oxide (9CI) Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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