2-(3-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)苯基)乙醇 | 651030-56-7
2-(3-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)苯基)乙醇
2-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanol
651030-56-7
C14H21BO3
248.1257
名称和标识符
MDL |
MFCD18733920 |
InChIKey |
NJOVPKLUJRKAGP-UHFFFAOYSA-N |
Inchi |
1S/C14H21BO3/c1-13(2)14(3,4)18-15(17-13)12-7-5-6-11(10-12)8-9-16/h5-7,10,16H,8-9H2,1-4H3 |
SMILES |
O1B(C2C([H])=C([H])C([H])=C(C([H])([H])C([H])([H])O[H])C=2[H])OC(C([H])([H])[H])(C([H])([H])[H])C1(C([H])([H])[H])C([H])([H])[H] |
别名信息
- 中文别名 -
- 3-(2-羟基乙基)苯基硼酸频哪醇酯
- 2-(3-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)苯基)乙醇
- 英文别名 -
- 2-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanol
- 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)Benzeneethanol
- Benzeneethanol, 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxoborane-2-yl)phenyl]ethanol
- AGN-PC-0CIY77
- AK-78375
- ANW-71549
- CTK1J9974
- KB-221327
- SureCN4315178
- 2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanol
- NJOVPKLUJRKAGP-UHFFFAOYSA-N
- 9962AB
- FCH2752384
- AX8224659
- ST24039264
- (3-(2-HYDROXYETHYL)PHENYL)BORONIC ACID PINACOL ESTER
- 2-[3-(TETRAMETHYL-1,
- BBB03056
- 2-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethan-1-ol
- SCHEMBL4315178
- MFCD18733920
- Y10140
- DS-17322
- 2-[3-(TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]ETHANOL
- DTXSID60729689
- CS-W006469
- 2-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethan-1-ol
- AMY22023
- AKOS016007416
- EN300-7417543
- 2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethan-1-ol
- 651030-56-7
- FT-0709712
物化性质
实验特性
LogP |
1.52060 |
PSA |
38.69000 |
计算特性
精确分子量 |
248.15800 |
氢键供体数量 |
1 |
氢键受体数量 |
3 |
可旋转化学键数量 |
3 |
同位素质量 |
248.1583747g/mol |
重原子数量 |
18 |
复杂度 |
275 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
拓扑分子极性表面积 |
38.7 |
海关数据
海关编码 |
2934999090 |
海关数据 |
中国海关编码:
2934999090
概述:
2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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