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
- Brc1ccc(C2CC2)nc1
- InChIKey
- WLJWEZIWWHAIEM-UHFFFAOYSA-N
- 分子式
- C8H8BrN
- 平均分子量
- 198.06 g/mol
- 单同位素质量
- 196.98401
COMPUTED
结构计算性质
- XLogP
- 2.1
- 极性表面积
- 12.9 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 1
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 122
ALIASES
名称与别名
5-Bromo-2-cyclopropylpyridine579475-29-93-Bromo-6-(cyclopropyl)pyridineMFCD120333695-Bromo-2-cyclopropyl-pyridineSCHEMBL588122SCHEMBL30600078DTXSID10624690WLJWEZIWWHAIEM-UHFFFAOYSA-NEYA47529AKOS015943386AB65328CS-W022305DS-17229SY118891DB-072393EN300-211291F318007
REACTIONS
参与反应
uspto-grants-2008_11 · 10.6084/m9.figshare.5104873.v1 · US07446113B2
查看uspto-grants-2008_11 · 10.6084/m9.figshare.5104873.v1 · US07446113B2
查看uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063048B2
查看uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063048B2
查看Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
查看uspto-grants-2007_07 · 10.6084/m9.figshare.5104873.v1 · US07238808B2
查看