Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- CNC(=O)C(Br)CCBr
- InChIKey
- HPCYZQZHUNXJPG-UHFFFAOYSA-N
- 分子式
- C5H9Br2NO
- 平均分子量
- 258.94 g/mol
- 单同位素质量
- 256.90509
COMPUTED
结构计算性质
- XLogP
- 1.5
- 极性表面积
- 29.1 Ų
- 氢键供体
- 1
- 氢键受体
- 1
- 可旋转键
- 3
- 重原子
- 9
- 形式电荷
- 0
- 复杂度
- 97
物化、安全与法规信息正在同步。
ALIASES
名称与别名
2,4-Dibromo-N-methylbutanamide132996-62-4Butanamide, 2,4-dibromo-N-methyl-SCHEMBL20722452,4-Dibromo-N-methylbutyramideN-methyl-2,4-dibromobutanamideN-methyl-2,4-dibromobutyramide2,4-dibromo-N-methyl-butanamideHPCYZQZHUNXJPG-UHFFFAOYSA-NMFCD26394904AKOS028109898N-methyl-2,4-dibromobutyric acid amideSY300500DB-313097
REACTIONS
相关反应
uspto-grants-2011_03 · 10.6084/m9.figshare.5104873.v1 · US07902200B2
查看uspto-grants-1990_11 · 10.6084/m9.figshare.5104873.v1 · US04973708
查看uspto-grants-1990_11 · 10.6084/m9.figshare.5104873.v1 · US04973708
查看uspto-grants-1990_11 · 10.6084/m9.figshare.5104873.v1 · US04973708
查看uspto-grants-1990_11 · 10.6084/m9.figshare.5104873.v1 · US04973708
查看uspto-grants-1991_07 · 10.6084/m9.figshare.5104873.v1 · US05032402
查看uspto-grants-1991_07 · 10.6084/m9.figshare.5104873.v1 · US05032402
查看