3-(4-吗啉甲基)苯硼酸频哪酯 | 364794-80-9
3-(4-吗啉甲基)苯硼酸频哪酯
4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
364794-80-9
C17H26BNO3
303.2042
名称和标识符
MDL |
MFCD06797489 |
InChIKey |
RCGRLLZELIIKDH-UHFFFAOYSA-N |
Inchi |
1S/C17H26BNO3/c1-16(2)17(3,4)22-18(21-16)15-7-5-6-14(12-15)13-19-8-10-20-11-9-19/h5-7,12H,8-11,13H2,1-4H3 |
SMILES |
O1B(C2C([H])=C([H])C([H])=C(C=2[H])C([H])([H])N2C([H])([H])C([H])([H])OC([H])([H])C2([H])[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-(4-吗啉甲基)苯硼酸频哪酯
- 4-[3-(4,4,5,5-四甲基-1,3,2-二氧硼烷-2-基)苄基]吗啉
- 3-(4-吗啉甲基)苯硼酸频哪醇酯
- 3-[4-(4,4,5,5-四甲基-1,3,2-二氧杂硼烷-2-基)苄基]吗啉
- 英文别名 -
- 4-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)morpholine
- 3-(4-Morpholinylmethyl)benzeneboronic acid pinacol ester
- 3-(Morpholinomethyl)phenylboronic acid pinacol ester
- 4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]morpholine
- 4-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl) benzyl]morpholine
- 4-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl]morpholine
- 4-{[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine
- morpholine, 4-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-
- 3-(4-MORPHOLINOMETHYL)PHENYLBORONIC ACID PINACOL ESTER
- AMTB039
- SCHEM
- PB20970
- PB20970
- DTXSID30383797
- DTXSID30383797
- RCGRLLZELIIKDH-UHFFFAOYSA-N
- RCGRLLZELIIKDH-UHFFFAOYSA-N
- A874343
- A874343
- (3-(MORPHOLINOMETHYL)PHENYL)BORONIC ACID PINACOL ESTER
- (3-(MORPHOLINOMETHYL)PHENYL)BORONIC ACID PINACOL ESTER
- AM86909
- AM86909
- 3-(4-MORPHOLINEMETHYL)BENZENEBORONIC ACID PINACOL ESTER
- 3-(4-MORPHOLINEMETHYL)BENZENEBORONIC ACID PINACOL ESTER
- 4-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine
- 4-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}morpholine
- SY021923
- SY021923
- 3-(4-MORPHOLINYLMETHYL)BENZENEBORONIC ACID PINACOL ESTER
- 3-(4-MORPHOLINYLMETHYL)BENZENEBORONIC ACID PINACOL ESTER
- 364794-80-9
- 364794-80-9
- AKOS015999576
- AKOS015999576
- 3-(Morpholin-4-ylmethyl)benzeneboronic acid, pinacol ester
- 3-(Morpholin-4-ylmethyl)benzeneboronic acid, pinacol ester
- 3-(MORPHOLINOMETHYL)PHENYLBORONIC ACID, PINACOL ESTER
- 3-(MORPHOLINOMETHYL)PHENYLBORONIC ACID, PINACOL ESTER
- J-514236
- J-514236
- 3-(4-Morpholinomethyl)phenylboronic acid pinacol ester, 95%
- 3-(4-Morpholinomethyl)phenylboronic acid pinacol ester, 95%
- CS-0045008
- CS-0045008
- EN300-1588562
- EN300-1588562
- SCHEMBL585841
- SCHEMBL585841
- AS-2281
- AS-2281
- MFCD06797489
- MFCD06797489
物化性质
实验特性
LogP |
1.75590 |
PSA |
30.93000 |
折射率 |
1.527 |
沸点 |
409.3°C at 760 mmHg |
熔点 |
52-56 °C |
闪点 |
华氏:>230 °F 摄氏:>110 °C
|
密度 |
1.08 |
计算特性
精确分子量 |
303.20100 |
氢键供体数量 |
0 |
氢键受体数量 |
4 |
可旋转化学键数量 |
3 |
同位素质量 |
303.2005739 g/mol |
重原子数量 |
22 |
复杂度 |
366 |
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 |
疏水参数计算参考值(XlogP) |
无 |
互变异构体数量 |
无 |
表面电荷 |
0 |
拓扑分子极性表面积 |
30.9 |
分子量 |
303.2 |
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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