2-氟-5-(甲酸乙酯)苯硼酸频那醇酯 | 944317-66-2
2-氟-5-(甲酸乙酯)苯硼酸频那醇酯
2-Fluoro-5-(methoxycarbonylmethyl)phenylboronic acid, pinacol ester
944317-66-2
C15H20BFO4
294.126308441162
名称和标识符
MDL |
MFCD12026092 |
InChIKey |
LTWSFTBHFDGCTE-UHFFFAOYSA-N |
Inchi |
1S/C15H20BFO4/c1-14(2)15(3,4)21-16(20-14)11-8-10(6-7-12(11)17)9-13(18)19-5/h6-8H,9H2,1-5H3 |
SMILES |
O=C(CC1C=C(B2OC(C)(C)C(C)(C)O2)C(F)=CC=1)OC |
别名信息
- 中文别名 -
- 2-氟-5-(甲酸乙酯)苯硼酸频那醇酯
- 2-氟-5-(甲氧基羰基甲基)苯硼酸频那醇酯
- 英文别名 -
- 2-FLUORO-5-(METHOXYCARBONYLMETHYL)PHENYLBORONIC ACID, PINACOL ESTER
- Methyl 2-(4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetate
- methyl 2-[4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate
- 2-Fluoro-5-(methoxycarbonylmethyl)phenylboronic acid,pinacol ester
- 2-Fluoro-5-(methoxycarbonylmethyl)phenylboronic acid pinacol ester
- methyl [4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate
- LTWSFTBHFDGCTE-UHFFFAOYSA-N
- Methyl 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzeneacetate (ACI)
- 2-[4-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetic acid methyl ester
- [4-Fluoro-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]acetic acid methyl ester
物化性质
实验特性
LogP |
1.84040 |
PSA |
44.76000 |
计算特性
精确分子量 |
294.14400 |
氢键供体数量 |
0 |
氢键受体数量 |
5 |
可旋转化学键数量 |
4 |
重原子数量 |
21 |
复杂度 |
383 |
拓扑分子极性表面积 |
44.8 |
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%
|