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
- OCCOCc1c(Cl)cccc1Cl
- InChIKey
- MCVIDUDFKDIJMZ-UHFFFAOYSA-N
- 分子式
- C9H10Cl2O2
- 平均分子量
- 221.08 g/mol
- 单同位素质量
- 220.0057849
COMPUTED
结构计算性质
- XLogP
- 2.1
- 极性表面积
- 29.5 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 4
- 重原子
- 13
- 形式电荷
- 0
- 复杂度
- 134
GHS
GHS分类
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.
Not Classified;Reported as not meeting GHS hazard criteria by 11 of 11 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 11 of 11 reports by companies.;There are 0 notifications provided by 0 of 11 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
HAZARDS
危害信息
Hazard Classes and Categories
Not Classified
ALIASES
名称与别名
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
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