HCID58601063

N-(4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(trifluoromethyl)benzamide

N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(trifluoromethyl)benzamide

C21H23BF3NO3405.2 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1B1OC(C)(C)C(C)(C)O1
InChIKey: CLPJDDCWLJOIBI-UHFFFAOYSA-N
分子式: C21H23BF3NO3
平均分子量: 405.2 g/mol
单同位素质量: 405.1723082

COMPUTED

结构计算性质

已同步

极性表面积: 47.6 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 3
重原子: 29
形式电荷: 0
复杂度: 594

ALIASES

名称与别名

共 16 条

876322-58-6N-(4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(trifluoromethyl)benzamideN-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(trifluoromethyl)benzamideN-[4-Methyl-3-(4,4,5,5-tetramethyl- [1,3,2]dioxaborolan-2-yl)-phenyl]-3-trifluoromethyl-benzamideSCHEMBL2887561SCHEMBL29536884MFCD21605391N-[4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-3-trifluoromethylbenzamideSY399013DB-343719EN300-372083A1-44141Z27681651332-Methyl-5-[3-(trifluoromethyl)benzamido]phenylboronic Acid Pinacol EsterN-[4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-3-tri-fluoromethyl-benzamideN-[4-methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-3-trifluoromethyl-benzamide

REACTIONS

参与反应

2 条

uspto-grants-2016_01 · 10.6084/m9.figshare.5104873.v1 · US09242969B2

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uspto-grants-2016_01 · 10.6084/m9.figshare.5104873.v1 · US09242969B2

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