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
- CC(=O)c1ccc2c(c1)CCCN2C(C)C
- InChIKey
- JKYZSTMAIRVVTA-UHFFFAOYSA-N
- 分子式
- C14H19NO
- 平均分子量
- 217.31 g/mol
- 单同位素质量
- 217.14666423
COMPUTED
结构计算性质
- XLogP
- 2.9
- 极性表面积
- 20.3 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 261
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1-[1-(1-methylethyl)-1,2,3,4-tetrahydroquinolin-6-yl)ethanone1-[1-(1-methylethyl)-1,2,3,4-tetrahydroquinolin-6-yl]ethanoneSCHEMBL7670996JKYZSTMAIRVVTA-UHFFFAOYSA-NDTXSID401182069179406-89-41-[1,2,3,4-Tetrahydro-1-(1-methylethyl)-6-quinolinyl]ethanone1-[1-(1-methylethyl)-1,2,3,4-tetra-hydroquinolin-6-yl]ethanone1-[1-(1-methylethyl)-1,2,3,4-tetrahydro-quinolin-6-yl)ethanone1-[1-(Propan-2-yl)-1,2,3,4-tetrahydroquinolin-6-yl]ethan-1-one
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看uspto-grants-2000_02 · 10.6084/m9.figshare.5104873.v1 · US06030964
查看uspto-grants-2000_02 · 10.6084/m9.figshare.5104873.v1 · US06030964
查看uspto-grants-2000_02 · 10.6084/m9.figshare.5104873.v1 · US06030964
查看uspto-grants-2001_09 · 10.6084/m9.figshare.5104873.v1 · US06291508B1
查看uspto-grants-2001_09 · 10.6084/m9.figshare.5104873.v1 · US06291508B1
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