HRID34135
uspto-grants-2008_09
作为反应物
uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07429609B2
查看IDENTITY
结构与身份
- 标准SMILES
- O=C1NCCCC1Br
- InChIKey
- CJFHQJDFNSXAOC-UHFFFAOYSA-N
- 分子式
- C5H8BrNO
- 平均分子量
- 178.03 g/mol
- 单同位素质量
- 176.97893
COMPUTED
结构计算性质
- XLogP
- 0.9
- 极性表面积
- 29.1 Ų
- 氢键供体
- 1
- 氢键受体
- 1
- 可旋转键
- 0
- 重原子
- 8
- 形式电荷
- 0
- 复杂度
- 105
物化、安全与法规信息正在同步。
ALIASES
名称与别名
3-Bromopiperidin-2-one3-Bromo-2-piperidinoneEINECS 252-023-2RefChem:499368252-023-234433-86-8MFCD098343992-Piperidinone, 3-bromo-a-Bromovalerolactam3-Bromo-2-piperidone3-Bromo-2-piperidinone #SCHEMBL5029979DTXSID80955983AKOS013464076SB43052AS-48296DA-06619SY1051683-Bromo-3,4,5,6-tetrahydropyridin-2-olCS-0072629
REACTIONS
参与反应
HRID102621
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看HRID316690
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看HRID1211420
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
查看HRID1241429
uspto-grants-2006_10
作为反应物
uspto-grants-2006_10 · 10.6084/m9.figshare.5104873.v1 · US07115597B2
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