4-BENZYLTHIOPHENYLBORONIC ACID 基本信息
| 中文名称 | 4-BENZYLTHIOPHENYLBORONIC ACID |
|---|---|
| 中文同义词 | 4-苄基硫代苯硼酸;四苄基硼酸;[4-(苄硫基)苯基]硼酸;(4-(苄基硫基)苯基)硼酸;4-苄基硫代苯基硼酸;B-[4-[(苯基甲基)硫基]苯基]硼酸 |
| 英文名称 | 4-Benzylthiophenylboronic acid |
| 英文同义词 | 4-(BENZYLSULFANYL)PHENYLBORONIC ACID;AKOS BRN-0551;Boronic acid, B-[4-[(phenylmethyl)thio]phenyl]-;B-[4-[(Phenylmethyl)thio]phenyl]boronic acid;4-(Benzylthio)benzeneboronic acid;4-Benzylthiophenylboronic acid - [B2404];B-[4-[(Benzyl)thio]phenyl]boronic acid;4-Benzylthiophenylboronic acid |
| CAS号 | 1005207-32-8 |
| 分子式 | C13H13BO2S |
| 分子量 | 244.12 |
| EINECS号 | |
| 相关类别 | |
| Mol文件 | Mol File |
| 结构式 |  |
4-BENZYLTHIOPHENYLBORONIC ACID 性质
| 熔点 | 148-149 °C(Solv: hexane (110-54-3)) |
|---|---|
| 沸点 | 435.4±55.0 °C(Predicted) |
| 密度 | 1.23±0.1 g/cm3(Predicted) |
| 酸度系数(pKa) | 8.52±0.17(Predicted) |
| 形态 | solid |
| InChI | 1S/C13H13BO2S/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2 |
| InChIKey | ALXFJPATEOZQPF-UHFFFAOYSA-N |
| SMILES | OB(O)C(C=C1)=CC=C1SCC2=CC=CC=C2 |