HCID58016188

(4-tert-Butyl-2-nitro-phenylethynyl)-trimethyl-silane

2-(4-tert-butyl-2-nitrophenyl)ethynyl-trimethylsilane

C15H21NO2Si275.42 g/molCAS 1147530-71-9

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)c1ccc(C#C[Si](C)(C)C)c([N+](=O)[O-])c1
InChIKey: CMANRTLAWXYIFS-UHFFFAOYSA-N
分子式: C15H21NO2Si
平均分子量: 275.42 g/mol
单同位素质量: 275.13415545

COMPUTED

结构计算性质

已同步

极性表面积: 45.8 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 3
重原子: 19
形式电荷: 0
复杂度: 400

ALIASES

名称与别名

共 8 条

1147530-71-94-(1,1-Dimethylethyl)-2-nitro-1-[2-(trimethylsilyl)ethynyl]benzeneSCHEMBL709464(4-tert-Butyl-2-nitro-phenylethynyl)-trimethyl-silaneCMANRTLAWXYIFS-UHFFFAOYSA-NDTXSID001165926DB-194277[(4-tert-Butyl-2-nitrophenyl)ethynyl](trimethyl)silane

REACTIONS

相关反应

11 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822457B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822457B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-2011_03 · 10.6084/m9.figshare.5104873.v1 · US07902194B2

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uspto-grants-2011_03 · 10.6084/m9.figshare.5104873.v1 · US07902194B2

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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uspto-grants-2012_02 · 10.6084/m9.figshare.5104873.v1 · US08124604B2

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