1-(环丙基甲基)-4-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)-1H-吡唑 | 1000801-75-1
1-(环丙基甲基)-4-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)-1H-吡唑
1-(cyclopropylmethyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1000801-75-1
C13H21BN2O2
248.1290
名称和标识符
| MDL |
MFCD15474887 |
| InChIKey |
LJUAHBJQFILHLS-UHFFFAOYSA-N |
| Inchi |
1S/C13H21BN2O2/c1-12(2)13(3,4)18-14(17-12)11-7-15-16(9-11)8-10-5-6-10/h7,9-10H,5-6,8H2,1-4H3 |
| SMILES |
O1B(C2C([H])=NN(C=2[H])C([H])([H])C2([H])C([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 -
- 1-(环丙基甲基)-4-(4,4,5,5-四甲基-1,3,2-二恶硼烷-2-基)-1H-吡唑
- 1-(环丙基甲基)-4-(4,4,5,5-四甲基-1,3,2-二噁硼烷-2-基)-1H-吡唑
- 1-(环丙基甲基)-1H-吡唑-4-硼酸频哪醇酯
- 1-(环丙基甲基)-吡唑-4-硼酸嚬哪醇酯
- 1-环丙基甲基-1H-吡唑-4-硼酸频哪醇酯
- 英文别名 -
- 1-(Cyclopropylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
- 1-Cyclopropylmethyl-1H-pyrazole-4-boronic acid, pinacol ester
- 1H-Pyrazole,1-(cyclopropylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
- 1-(cyclopropylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
- 1-(cyclopropylmethyl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
- 1-CYCLOPROPYLMETHYL-4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-1H-PYRAZOLE
- LJUAHBJQFILHLS-UHFFFAOYSA-N
- SB12170
- RP28797
- AM90000
- DS-1
- 1-Cyclopropylmethyl-1H-pyrazole-4-boronic acid pinacol ester
物化性质
实验特性
| LogP |
1.59230 |
| PSA |
36.28000 |
| 密度 |
1.14 |
计算特性
| 精确分子量 |
248.17000 |
| 氢键供体数量 |
0 |
| 氢键受体数量 |
3 |
| 可旋转化学键数量 |
3 |
| 重原子数量 |
18 |
| 复杂度 |
315 |
| 拓扑分子极性表面积 |
36.3 |
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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