uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846845B2
查看IDENTITY
结构与身份
- 标准SMILES
- O=C(COc1ccc([N+](=O)[O-])cc1)OCCO
- InChIKey
- FYPBEHMCFWPXCQ-UHFFFAOYSA-N
- 分子式
- C10H11NO6
- 平均分子量
- 241.2 g/mol
- 单同位素质量
- 241.05863707
COMPUTED
结构计算性质
- XLogP
- 1.1
- 极性表面积
- 102 Ų
- 氢键供体
- 1
- 氢键受体
- 6
- 可旋转键
- 6
- 重原子
- 17
- 形式电荷
- 0
- 复杂度
- 256
ALIASES
名称与别名
SCHEMBL829911FYPBEHMCFWPXCQ-UHFFFAOYSA-N(4-Nitrophenoxy)-acetic acid-2-hydroxy-ethyl ester(4-Nitro-phenoxy)-acetic acid-2-hydroxy-ethyl ester
REACTIONS
参与反应
uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846845B2
查看uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846845B2
查看uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846845B2
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
查看Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07772352B2
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