Cas no 947534-30-7 (5-bromo-N-(3-nitrocyclobutyl)pyridin-2-amine)
947534-30-7 structure
Product Name:5-bromo-N-(3-nitrocyclobutyl)pyridin-2-amine
CAS No:947534-30-7
MF:C9H10BrN3O2
MW:272.09860086441
CID:870202
PubChem ID:45158683
Update Time:2025-04-19
5-bromo-N-(3-nitrocyclobutyl)pyridin-2-amine Chemical and Physical Properties
Names and Identifiers
-
- 5-bromo-N-(3-nitrocyclobutyl)pyridin-2-amine
- 5-BROMO-3-NITRO-(PYRIDIN-2-YL))-CYCLOBUTYL-AMINE
- 5-Bromo-3-nitro-pyridin-2-yl)-cyclobutyl-amine
- AKOS011704900
- 947534-30-7
-
- Inchi: 1S/C9H10BrN3O2/c10-6-4-8(13(14)15)9(11-5-6)12-7-2-1-3-7/h4-5,7H,1-3H2,(H,11,12)
- InChI Key: BTRLHRIMRXFTDW-UHFFFAOYSA-N
- SMILES: BrC1=CN=C(C(=C1)[N+](=O)[O-])NC1CCC1
Computed Properties
- Exact Mass: 270.99600
- Monoisotopic Mass: 270.99564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 242
- 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: 3.2
- Topological Polar Surface Area: 70.7?2
Experimental Properties
- PSA: 70.74000
- LogP: 3.31290
5-bromo-N-(3-nitrocyclobutyl)pyridin-2-amine Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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