5-(4,4,5,5-四甲基-[1,3,2]二氧硼烷)烟腈 | 402718-29-0
5-(4,4,5,5-四甲基-[1,3,2]二氧硼烷)烟腈
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile
402718-29-0
C12H15BN2O2
230.0707
名称和标识符
MDL |
MFCD07780755 |
InChIKey |
BOIKCRIMIQAFQJ-UHFFFAOYSA-N |
Inchi |
1S/C12H15BN2O2/c1-11(2)12(3,4)17-13(16-11)10-5-9(6-14)7-15-8-10/h5,7-8H,1-4H3 |
SMILES |
O1B(C2C([H])=NC([H])=C(C#N)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 -
- 5-(4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷-2-基)烟腈
- 3-氰基吡啶-5-硼酸频哪醇酯
- 2-重氮-1-萘酚-5-磺酸钠
- 5-(4,4,5,5-四甲基-[1,3,2]二氧硼烷)烟腈
- 2-(5-氰基-3-吡啶基)-4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷
- 3-氰基-5-(4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷-2-基)吡啶
- 英文别名 -
- 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile
- 3-Cyanopyridine-5-boronic acid pinacol ester
- 3-Pyridinecarbonitrile,5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)nicotinonitrile
- 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile?
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
- 2-(5-Cyano-3-pyridyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- 3-Cyano-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
- Nicotinonitrile-5-boronic acid pinacol ester
- 3-Pyridinecarbonitrile, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 3-CYANO-5-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)PYRIDINE
- AMBA00005
- 3-Cyanopyridine-5-boronic Acid Pinacol Ester
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile
- DTXSID20585960
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-Pyridinecarbonitrile
- 5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
- 3-Cyanopyridine-5-boronic acid pinacol ester, AldrichCPR
- SY024859
- T3514
- CS-0041845
- DS-16249
- 402718-29-0
- AKOS016003071
- AC1997
- Z1391882724
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile?
- BOIKCRIMIQAFQJ-UHFFFAOYSA-N
- AB42552
- SCHEMBL137719
- J-516199
- Nicotinonitrile-5-boronic acid pinacol ester
- 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carbonitrile
- MFCD07780755
- AM20051161
- 5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-nicotinonitrile
- 2-Pyrrolidinone,3-amino-1-hydroxy-
- A25366
- EN300-318545
- 3-CYANOPYRIDINE-5-BORONIC ACID PINACOL ESTER
- (5-Cyanopyridin-3-yl)boronic acid pinacol ester
物化性质
实验特性
LogP |
0.20688 |
PSA |
86.37000 |
折射率 |
1.507 |
沸点 |
352.638°C at 760 mmHg |
熔点 |
132.0 to 136.0 deg-C |
闪点 |
167.07°C |
密度 |
1.107 |
计算特性
精确分子量 |
248.13300 |
氢键供体数量 |
0 |
氢键受体数量 |
4 |
可旋转化学键数量 |
1 |
同位素质量 |
230.1226579g/mol |
重原子数量 |
17 |
复杂度 |
332 |
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 |
55.1 |
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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