HCID70817554

2-(1-Cyclopropyl-5-(trifluoromethyl)-1H-pyrazol-4-yl)acetonitrile

2-[1-cyclopropyl-5-(trifluoromethyl)pyrazol-4-yl]acetonitrile

C9H8F3N3215.17 g/molCAS 1402445-92-4

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IDENTITY

结构与身份

标准SMILES: N#CCc1cnn(C2CC2)c1C(F)(F)F
InChIKey: PSTWQTNMDVACFM-UHFFFAOYSA-N
分子式: C9H8F3N3
平均分子量: 215.17 g/mol
单同位素质量: 215.06703175

COMPUTED

结构计算性质

已同步

XLogP: 1.3
极性表面积: 41.6 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 2
重原子: 15
形式电荷: 0
复杂度: 289

ALIASES

名称与别名

共 7 条

1402445-92-42-(1-Cyclopropyl-5-(trifluoromethyl)-1H-pyrazol-4-yl)acetonitrile(1-Cyclopropyl-5-trifluoromethyl-1H-pyrazol-4-yl)-acetonitrileSCHEMBL12985165DTXSID6011870891-Cyclopropyl-5-(trifluoromethyl)-1H-pyrazole-4-acetonitrile[1-Cyclopropyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]acetonitrile

REACTIONS

参与反应

4 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846698B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846698B2

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uspto-grants-2015_10 · 10.6084/m9.figshare.5104873.v1 · US09163021B2

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uspto-grants-2015_10 · 10.6084/m9.figshare.5104873.v1 · US09163021B2

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