Cas no 2891517-47-6 (6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine)
2891517-47-6 structure
Product Name:6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine
CAS No:2891517-47-6
MF:C6H7BrN2
MW:192.067988634109
CID:6827600
PubChem ID:172403346
Update Time:2025-02-15
6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine Chemical and Physical Properties
Names and Identifiers
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- 2891517-47-6
- 6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine
- CS-25878
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- Inchi： 1S/C6H7BrN2/c1-4-2-3-5(8)9-6(4)7/h2-3H,1H3,(H2,8,9)/i1D3,2D,3D
- InChI Key： DDCMBKXJOGOCPM-RHIBPKLGSA-N
- SMILES： BrC1C(C([2H])([2H])[2H])=C([2H])C([2H])=C(N)N=1
Computed Properties
- Exact Mass: 191.01064Da
- Monoisotopic Mass: 191.01064Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 97.1
- 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: 1.9
- Topological Polar Surface Area: 38.9?2
6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine Related Literature
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
2891517-47-6 (6-bromo-5-(methyl-d3)pyridin-3,4-d2-2-amine) Related Products
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