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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
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:5-(4,4,5,5-四甲基-[1,3,2]二氧硼烷)烟腈结构式
16414216
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%

专业数据库参考
PubChemId 16414216
参考资料
Reaxys RN 14676288
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