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
- Cc1noc(N)c1Br
- InChIKey
- XCYKKCVEVOZFIL-UHFFFAOYSA-N
- 分子式
- C4H5BrN2O
- 平均分子量
- 177 g/mol
- 单同位素质量
- 175.95853
COMPUTED
结构计算性质
- XLogP
- 1.1
- 极性表面积
- 52.1 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 0
- 重原子
- 8
- 形式电荷
- 0
- 复杂度
- 90
物化、安全与法规信息正在同步。
ALIASES
名称与别名
4-Bromo-3-methylisoxazol-5-amine33084-49-0DTXSID70440671RefChem:290885DTXCID303914935-Amino-4-bromo-3-methylisoxazole4-bromo-3-methyl-1,2-oxazol-5-amine4-bromo-3-methyl-2,5-dihydro-1,2-oxazol-5-imine1356635-81-84-bromo-3-methyl-5-isoxazolamineMFCD09038913F2150-00184-bromo-3-methylisoxazole-5-ylamine4-bromo-3-methyl-5-amino-isoxazole5-Isoxazolamine, 4-bromo-3-methyl-SCHEMBL46320275-amino-4-bromo-3methylisoxazoleXCYKKCVEVOZFIL-UHFFFAOYSA-N4-bromo-3-methyl-5-aminoisoxazole4-bromo-3-methyl5-amino-isoxazole
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看uspto-grants-1995_11 · 10.6084/m9.figshare.5104873.v1 · US05464853
查看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
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