uspto-grants-2014_01 · 10.6084/m9.figshare.5104873.v1 · US08623905B2
查看IDENTITY
结构与身份
- 标准SMILES
- COC(=O)C1(c2ccc([N+](=O)[O-])cc2)CC1
- InChIKey
- WZBRUNXCRWCZBL-UHFFFAOYSA-N
- 分子式
- C11H11NO4
- 平均分子量
- 221.21 g/mol
- 单同位素质量
- 221.06880783
COMPUTED
结构计算性质
- XLogP
- 1.9
- 极性表面积
- 72.1 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 3
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 298
ALIASES
名称与别名
23348-98-3Methyl 1-(4-nitrophenyl)cyclopropane-1-carboxylate1-(4-nitro-phenyl)-cyclopropanecarboxylic acid methyl esterCyclopropanecarboxylic acid, 1-(4-nitrophenyl)-, methyl esterMFCD20040022methyl 1-(4-nitrophenyl)cyclopropanecarboxylate1-(4-Nitrophenyl)-cyclopropanecarboxylic acid methyl esterSCHEMBL1465773WZBRUNXCRWCZBL-UHFFFAOYSA-NAKOS028108296AS-6447DB-354010D78728F521853
REACTIONS
参与反应
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