Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
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IDENTITY
结构与身份
- 标准SMILES
- F[n+]1ccccc1
- InChIKey
- UWDCUCCPBLHLTI-UHFFFAOYSA-N
- 分子式
- C5H5FN+
- 平均分子量
- 98.1 g/mol
- 单同位素质量
- 98.04060233
COMPUTED
结构计算性质
- XLogP
- 0.5
- 极性表面积
- 3.9 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 0
- 重原子
- 7
- 形式电荷
- 1
- 复杂度
- 50
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1-fluoropyridin-1-iumPyridinium, 1-fluoro-88795-94-2SCHEMBL65488UWDCUCCPBLHLTI-UHFFFAOYSA-DTXSID60369165InChI=1/C5H5FN/c6-7-4-2-1-3-5-7/h1-5H/q+1
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (10/10) · 10.1039/C8SC04228D
查看