Pd_CN_Coupling_Informer_Library · 10.1039/c5sc04751j
查看IDENTITY
结构与身份
- 标准SMILES
- Cn1c2ccccc2c2cc(B3OC(C)(C)C(C)(C)O3)ccc21
- InChIKey
- AVCKYKVGQYBADD-UHFFFAOYSA-N
- 分子式
- C19H22BNO2
- 平均分子量
- 307.2 g/mol
- 单同位素质量
- 307.1743591
COMPUTED
结构计算性质
- 极性表面积
- 23.4 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 1
- 重原子
- 23
- 形式电荷
- 0
- 复杂度
- 450
GHS
GHS分类
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
HAZARDS
危害信息
Hazard Classes and Categories
Aquatic Chronic 4 (100%)
ALIASES
名称与别名
1217891-71-89-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazoleDTXSID00718875RefChem:313189DTXCID506696219-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole9-Methyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-9H-carbazoleMFCD162945529-Methylcarbazole-3-boronic acid pinacol esterAVCKYKVGQYBADD-UHFFFAOYSA-NSCHEMBL31153AKOS025392307AS-2454CS-0177012F87769F6968649-Methyl-9H-carbazole-3-boronic acid pinacol ester, 95%9-Methyl-3-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole;N-Methylcarbazole-3-boronic acid pinacol ester;9-Methyl-9H-carbazole-3-boronic acid pinacol ester
REACTIONS