Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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IDENTITY
结构与身份
- 标准SMILES
- CCO[Si](CCCOc1ccc(C(=O)c2ccccc2)c(O)c1)(OCC)OCC
- InChIKey
- CCGWVKHKHWKOIQ-UHFFFAOYSA-N
- 分子式
- C22H30O6Si
- 平均分子量
- 418.6 g/mol
- 单同位素质量
- 418.18116521
COMPUTED
结构计算性质
- 极性表面积
- 74.2 Ų
- 氢键供体
- 1
- 氢键受体
- 6
- 可旋转键
- 13
- 重原子
- 29
- 形式电荷
- 0
- 复杂度
- 451
GHS
GHS分类
GHS Classification
H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
HAZARDS
危害信息
Regulatory Information
Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2856
Hazard Classes and Categories
Aquatic Chronic 2 (100%)
Hazardous to the aquatic environment (chronic) - category 2
Aquatic Chronic 2
REGULATORY
法规信息
Regulatory Information
Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2856
ALIASES
名称与别名
79876-59-82-hydroxy-4-(3-triethoxysilylpropoxy)diphenyl ketoneEC 431-490-8DTXSID5012189244-(3-triethoxysilylpropoxy)-2-hydroxybenzophenoneRefChem:473187DTXCID101650235431-490-82-hydroxy-4-(3-triethoxysilylpropoxy)diphenylketone(2-Hydroxy-4-(3-(triethoxysilyl)propoxy)phenyl)(phenyl)methanone[2-hydroxy-4-(3-triethoxysilylpropoxy)phenyl]-phenylmethanone{2-Hydroxy-4-[3-(triethoxysilyl)propoxy]phenyl}(phenyl)methanoneC22H30O6SiSCHEMBL239477SCHEMBL29409195s251934-(3'-triethoxysilylpropoxy)-2-hydroxybenzophenone[2-hydroxy-4-(3-triethoxysilylpropoxy)phenyl]-phenyl-methanone2-Hydroxy-4-(3-triethoxysilyl-propoxy)-diphenylketone,tech-95
REACTIONS
