HCID66866377

2-(2-Cyclopropylmethoxy-4-fluoro-5-methoxy-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

2-[2-(cyclopropylmethoxy)-4-fluoro-5-methoxyphenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C17H24BFO4322.2 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1cc(B2OC(C)(C)C(C)(C)O2)c(OCC2CC2)cc1F
InChIKey: VDZYOKMTQIOYQQ-UHFFFAOYSA-N
分子式: C17H24BFO4
平均分子量: 322.2 g/mol
单同位素质量: 322.1751676

COMPUTED

结构计算性质

已同步

极性表面积: 36.9 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 5
重原子: 23
形式电荷: 0
复杂度: 411

ALIASES

名称与别名

共 4 条

SCHEMBL982646VDZYOKMTQIOYQQ-UHFFFAOYSA-N2-(2-Cyclopropylmethoxy-4-fluoro-5-methoxy-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane2-(2-cyclopropylmethoxy-4-fluoro-5-methoxyphenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

REACTIONS

参与反应

12 条

Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2015_01 · 10.6084/m9.figshare.5104873.v1 · US08927557B2

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uspto-grants-2015_01 · 10.6084/m9.figshare.5104873.v1 · US08927557B2

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uspto-grants-2015_01 · 10.6084/m9.figshare.5104873.v1 · US08927557B2

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08445501B2

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08445501B2

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uspto-grants-2016_06 · 10.6084/m9.figshare.5104873.v1 · US09376442B2

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uspto-grants-2016_06 · 10.6084/m9.figshare.5104873.v1 · US09376442B2

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