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结构：CCOC(=O)C(C)(Cc1ccc(O)cc1)Oc1ccccc1F
HCID57719263

2-(2-Fluorophenoxy)-3-(4-hydroxyphenyl)-2-methyl-propionic acid ethyl ester

ethyl 2-(2-fluorophenoxy)-3-(4-hydroxyphenyl)-2-methylpropanoate

C18H19FO4318.3 g/mol
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IDENTITY

结构与身份

标准 SMILES
CCOC(=O)C(C)(Cc1ccc(O)cc1)Oc1ccccc1F
InChIKey
KBQOZXKDJFZITE-UHFFFAOYSA-N
分子式
C18H19FO4
平均分子量
318.3 g/mol
单同位素质量
318.12673725

COMPUTED

结构计算性质

已同步
XLogP
4.1
极性表面积
55.8 Ų
氢键供体
1
氢键受体
5
可旋转键
7
重原子
23
形式电荷
0
复杂度
381

ALIASES

名称与别名

共 8 条
SCHEMBL3996969KBQOZXKDJFZITE-UHFFFAOYSA-N2-(2-Fluoro- phenoxy)-3-(4-hydroxy-phenyl)-2-methyl-propionic acid ethyl ester2-(2-Fluoro-phenoxy)-3-(4-hydroxy- phenyl)-2-methyl-propionic acid ethyl ester2-(2-Fluoro-phenoxy)-3-(4-hydroxy-phenyl)-2-methyl-propionic acid ethyl ester2-(2-fluoro-phenoxy)-3-(4-hydroxyphenyl)-2-methyl-propionic acid ethyl ester2-(2-fluorophenoxy)-3-(4-hydroxy-phenyl)-2-methyl-propionic acid ethyl ester2-(2-Fluorophenoxy)-3-(4-hydroxyphenyl)-2-methyl-propionic acid ethyl ester

REACTIONS

参与反应

11 条
全部作为反应物作为生成物作为试剂作为催化剂作为溶剂
HRID1137541

Training data from https://doi.org/10.1039/C8SC04228D (7/10)

作为生成物
HRID 1137541 方程式

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

查看条件与参与物
HRID1556509

Training data from https://doi.org/10.1039/C8SC04228D (1/10)

作为反应物
HRID 1556509 方程式

Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

查看条件与参与物