Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- COc1nc(Cl)ncc1F
- InChIKey
- HLVJKADQILYNGE-UHFFFAOYSA-N
- 分子式
- C5H4ClFN2O
- 平均分子量
- 162.55 g/mol
- 单同位素质量
- 161.9996186
COMPUTED
结构计算性质
- XLogP
- 1.6
- 极性表面积
- 35 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 1
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 116
物化、安全与法规信息正在同步。
ALIASES
名称与别名
2-CHLORO-5-FLUORO-4-METHOXYPYRIMIDINE37554-70-4DTXSID70543075RefChem:258931DTXCID90493861641-268-42-chloro-5-fluoro-4-methoxy-pyrimidineMFCD07440062Pyrimidine, 2-chloro-5-fluoro-4-methoxy-SCHEMBL1997439HLVJKADQILYNGE-UHFFFAOYSA-NALBB-018209SBB0876492-chloro-4-methoxy-5-fluoropyrimidineAKOS002666052GS-5550SB57295SY083854CS-0045717F313136
REACTIONS
参与反应
uspto-grants-2014_06 · 10.6084/m9.figshare.5104873.v1 · US08759366B2
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查看uspto-grants-2016_04 · 10.6084/m9.figshare.5104873.v1 · US09321756B2
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2016_03 · 10.6084/m9.figshare.5104873.v1 · US09290490B2
查看uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08551984B2
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