Cas no 2806718-82-9 (5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3)
2806718-82-9 structure
Product Name:5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3
CAS No:2806718-82-9
MF:C6H4BrF2NO
MW:228.027514457703
CID:6827129
PubChem ID:172403881
Update Time:2025-02-19
5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3 Chemical and Physical Properties
Names and Identifiers
-
- CS-25389
- 5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3
- 2806718-82-9
-
- Inchi： 1S/C6H4BrF2NO/c7-4-1-2-5(11)10(3-4)6(8)9/h1-3,6H/i1D,2D,3D,6D
- InChI Key： KMAQQDDPRGOPRF-VTBMLFEUSA-N
- SMILES： BrC1C([2H])=C([2H])C(N(C([2H])(F)F)C=1[2H])=O
Computed Properties
- Exact Mass: 226.96954Da
- Monoisotopic Mass: 226.96954Da
- Isotope Atom Count: 4
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 237
- 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: 1.7
- Topological Polar Surface Area: 20.3?2
5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3 Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
2806718-82-9 (5-bromo-1-(difluoromethyl-d)pyridin-2(1H)-one-3,4,6-d3) Related Products
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