HCID67485286

3-Phenoxy-5-(trifluoromethyl)picolinonitrile

3-phenoxy-5-(trifluoromethyl)pyridine-2-carbonitrile

C13H7F3N2O264.2 g/mol

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IDENTITY

结构与身份

标准SMILES: N#Cc1ncc(C(F)(F)F)cc1Oc1ccccc1
InChIKey: LMVZMYGDKFGEHS-UHFFFAOYSA-N
分子式: C13H7F3N2O
平均分子量: 264.2 g/mol
单同位素质量: 264.05104734

COMPUTED

结构计算性质

已同步

XLogP: 3.3
极性表面积: 45.9 Å²
氢键供体: 0
氢键受体: 6
可旋转键: 2
重原子: 19
形式电荷: 0
复杂度: 344

ALIASES

名称与别名

共 11 条

1065607-70-63-phenoxy-5-(trifluoromethyl)picolinonitrile3-phenoxy-5-(trifluoromethyl)pyridine-2-carbonitrile2-Cyano-3-phenoxy-5-(trifluoromethyl)pyridineMFCD259705803-Phenoxy-5-trifluoromethyl-pyridine-2-carbonitrileSCHEMBL2654740AKOS025141956CS-10702CS-0449824F511293

REACTIONS

相关反应

4 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 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-2013_01 · 10.6084/m9.figshare.5104873.v1 · US08362037B2

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uspto-grants-2013_01 · 10.6084/m9.figshare.5104873.v1 · US08362037B2

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