uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07732613B2
查看IDENTITY
结构与身份
- 标准SMILES
- O=C(O)c1cccc(-c2ccc(F)cc2)n1
- InChIKey
- WEEVXEKXCIBZMB-UHFFFAOYSA-N
- 分子式
- C12H8FNO2
- 平均分子量
- 217.2 g/mol
- 单同位素质量
- 217.05390666
COMPUTED
结构计算性质
- XLogP
- 2.5
- 极性表面积
- 50.2 Ų
- 氢键供体
- 1
- 氢键受体
- 4
- 可旋转键
- 2
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 251
ALIASES
名称与别名
6-(4-fluorophenyl)picolinic acid863704-60-36-(4-Fluorophenyl)pyridine-2-carboxylic acid6-(4-Fluorophenyl)-picolinic acidMFCD06410054SCHEMBL1137226SCHEMBL30367705DTXSID30610616WEEVXEKXCIBZMB-UHFFFAOYSA-NAKOS016013072AB23959SY015583TS-03098CS-0187172C768026-(4-Fluoro-phenyl)-pyridine-2-carboxylic acidEN300-6746773F066022Z1508928488
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看uspto-grants-2007_02 · 10.6084/m9.figshare.5104873.v1 · US07173031B2
查看Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07662839B2
查看uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07662839B2
查看uspto-grants-2010_02 · 10.6084/m9.figshare.5104873.v1 · US07662839B2
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