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
- Clc1ccccc1OCC1CO1
- InChIKey
- IYFFPRFMOMGBGB-UHFFFAOYSA-N
- 分子式
- C9H9ClO2
- 平均分子量
- 184.62 g/mol
- 单同位素质量
- 184.0291072
COMPUTED
结构计算性质
- XLogP
- 2.2
- 极性表面积
- 21.8 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 12
- 形式电荷
- 0
- 复杂度
- 151
ALIASES
名称与别名
2-(2-chlorophenoxymethyl)oxirane2-[(2-chlorophenoxy)methyl]oxirane2212-04-61-(2-Chlorophenoxy)-2,3-epoxypropaneo-chlorophenyl glycidyl etherMFCD08752554NSC602592-chlorophenyl glycidyl etherSCHEMBL1109726SCHEMBL9732356SCHEMBL9732359SCHEMBL9732664SCHEMBL29425003IYFFPRFMOMGBGB-UHFFFAOYSA-N2-(2-Chloro-phenoxymethyl)-oxiraneNSC 60259NSC-60259AKOS000122882AKOS016051103SB45699
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看uspto-grants-1985_07 · 10.6084/m9.figshare.5104873.v1 · US04532239
查看uspto-grants-1978_02 · 10.6084/m9.figshare.5104873.v1 · US04075208
查看uspto-grants-1978_02 · 10.6084/m9.figshare.5104873.v1 · US04075335
查看Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看uspto-grants-2003_02 · 10.6084/m9.figshare.5104873.v1 · US06521667B1
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