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
- Cc1ccc(C=C[N+](=O)[O-])o1
- InChIKey
- YUGJJOVWZWUBQX-UHFFFAOYSA-N
- 分子式
- C7H7NO3
- 平均分子量
- 153.14 g/mol
- 单同位素质量
- 153.04259309
COMPUTED
结构计算性质
- XLogP
- 1.7
- 极性表面积
- 59 Ų
- 氢键供体
- 0
- 氢键受体
- 3
- 可旋转键
- 1
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 173
ALIASES
名称与别名
2-methyl-5-(2-nitrovinyl)furan30796-84-0DTXSID10337036RefChem:263489DTXCID00288124Furan, 2-methyl-5-(2-nitroethenyl)-SCHEMBL1871013(5-methylfuryl)-2-nitroethyleneYUGJJOVWZWUBQX-UHFFFAOYSA-N2-Methyl-5-(2-nitrovinyl) furan2-Methyl-5-(2-nitro-vinyl)-furanAKOS0174335582-Methyl-5-(2-nitroethen-1-yl)furan
REACTIONS
参与反应
uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07947689B2
查看uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07947689B2
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2012_07 · 10.6084/m9.figshare.5104873.v1 · US08217031B2
查看uspto-grants-2012_07 · 10.6084/m9.figshare.5104873.v1 · US08217031B2
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