Cas no 2256714-35-7 ((3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid)
2256714-35-7 structure
Product Name:(3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid
CAS No:2256714-35-7
MF:C7H8BFO2
MW:159.983595848083
CID:6825865
PubChem ID:172402129
Update Time:2025-03-02
(3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid Chemical and Physical Properties
Names and Identifiers
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- 2256714-35-7
- CS-24021
- (3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid
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- Inchi： 1S/C7H8BFO2/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4,10-11H,1H3/i1D3,2D,3D,4D
- InChI Key： QQPLHUGOUZKARP-RLTMCGQMSA-N
- SMILES： FC1C([2H])=C(B(O)O)C([2H])=C(C([2H])([2H])[2H])C=1[2H]
Computed Properties
- Exact Mass: 160.0977983Da
- Monoisotopic Mass: 160.0977983Da
- Isotope Atom Count: 6
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 132
- 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
- Topological Polar Surface Area: 40.5?2
(3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
2256714-35-7 ((3-fluoro-5-(methyl-d3)phenyl-2,4,6-d3)boronic acid) Related Products
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