Cas no 1946807-79-9 (4-Bromo-5-chloro-3-nitropyridin-2-amine)
1946807-79-9 structure
Product Name:4-Bromo-5-chloro-3-nitropyridin-2-amine
CAS No:1946807-79-9
MF:C5H3BrClN3O2
MW:252.453218698502
CID:4709885
Update Time:2023-08-16
4-Bromo-5-chloro-3-nitropyridin-2-amine Chemical and Physical Properties
Names and Identifiers
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- 4-Bromo-5-chloro-3-nitropyridin-2-amine
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- Inchi： 1S/C5H3BrClN3O2/c6-3-2(7)1-9-5(8)4(3)10(11)12/h1H,(H2,8,9)
- InChI Key： NFIHUVMOQSYBFL-UHFFFAOYSA-N
- SMILES： BrC1C(=CN=C(C=1[N+](=O)[O-])N)Cl
Computed Properties
- Exact Mass: 250.90972 g/mol
- Monoisotopic Mass: 250.90972 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 188
- 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
- Molecular Weight: 252.45
- XLogP3: 2.2
- Topological Polar Surface Area: 84.7
4-Bromo-5-chloro-3-nitropyridin-2-amine Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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