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4-羧基苯硼酸频那醇酯 | 180516-87-4

4-羧基苯硼酸频那醇酯
4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
180516-87-4
C13H17BO4
248.0827
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:4-羧基苯硼酸频那醇酯结构式
2734621
名称和标识符
MDL MFCD01863710
InChIKey IYDKBQIEOBXLTP-UHFFFAOYSA-N
Inchi 1S/C13H17BO4/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3,(H,15,16)
SMILES O1B(C2C([H])=C([H])C(C(=O)O[H])=C([H])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 -
  • 4-羧基苯硼酸频那醇酯
  • 对羧基苯硼酸频哪醇酯
  • 4-(4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷-2-基)苯甲酸
  • 4-羧基苯基硼酸频哪醇酯
  • 4-羧基苯硼酸嚬哪醇酯
  • 4-(4,4,5,5-四甲基-1,3,2-二杂氧戊硼烷-2-基)苯甲酸
  • 4-(4,4,5,5-四甲基-1,3,2-二氧杂硼烷-2-基)安息香酸
  • 4-羧苯硼酸频哪酯
  • 4-羧基苯硼酸频哪酯
  • (R)-5-苯二酰亚氨基-2-溴戊酸
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic Acid 4-(4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷-2-基)苯甲酸
  • 4-羧基苯硼酸频呐醇酯
  • 对羧基苯硼酸频哪醇酯及合成技术
  • 2-(4-羧基苯基)-4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷
  • 4-(4,4,5,5-四甲基-1,3,2-二氧杂硼烷-2-基)苯甲酸
  • 4-羧基苯硼酸频哪醇酯
  • 4-羧基苯硼酸频呢醇酯
  • 4-羧基苯基硼酸风梨醇酯
- 英文别名 -
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
  • 4-CARBOXYBENZENEBORONIC ACID PINACOL CYCLIC ESTER
  • 4-CARBOXYPHENYLBORONIC ACID PINACOLATE
  • 4-CARBOXYPHENYLBORONIC ACID, PINACOL CYCLIC ESTER
  • 4-CARBOXYPHENYLBORONIC ACID, PINACOL ESTER
  • [4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABORINAN-2-YL) BENZOIC ACID]
  • 4-CARBOXYPHENYLBORONIC ACID PINACOL ESRER
  • 4-Carboxybenzeneboronic acid pinacol ester
  • 4-Carboxylphenylboronic acid pinacol ester
  • 2-(4-Carboxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 4-Carboxyphen
  • 4-(tetraMethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
  • 4-Carboxyphenylboronic Acid Pinacol Ester
  • 4-Carboxylphenylboronic acid pinacol ester 97%
  • 4-Carboxybenzeneboronic acid pinacol ester, 97%
  • 4-Carboxyphenylboronicacidpinacolester
  • 4-carboxyphenylboronic acid,pinacol ester
  • BENZOIC ACID, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-
  • 2-(4-Carboxyphenyl)-4,4,5,5-tetramethyl
  • 4-carboxylphenylboronic acid pinacol ester
  • 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOIC ACID
  • 4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
  • 4-carboxyphenylboronic acid pinacolate
  • T2841
  • 4-carboxybenzeneboronic acid pinacolcyclicester
  • DTXSID90370401
  • SCHEMBL105188
  • 4-BORONOBENZOIC ACID PINACOL ESTER
  • (4-carboxyphenyl)boronic acid pinacol ester
  • MFCD01863710
  • 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)benzoic acid
  • 4-(hydroxy(3-hydroxy-2,3-dimethylbutan-2-yloxy)boryl)benzoic acid
  • SY002371
  • 4-carboxyphenylboronic acid, pinacol ester
  • J-513429
  • 4-(4,4,5,5-tetrameyl-1,3,2-dioxaborolan-2-yl)benzoic acid
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-benzoic acid
  • J-011531
  • HY-W000887
  • 4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzoic acid
  • FT-0643741
  • AC-6993
  • 4-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)-benzoic acid
  • 4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)benzoic acid
  • 4-carboxyphenylboronic acid, pinacol cyclic ester
  • 4-Carboxyphenylboronic acid pinacol ester
  • AS-2258
  • A4001
  • IYDKBQIEOBXLTP-UHFFFAOYSA-N
  • Z1324655439
  • 4-Carboxylphenylboronic acid pinacol ester, 97%
  • AKOS015915428
  • AM20050295
  • 4-carboxybenzeneboronic acid, pinacol ester
  • 180516-87-4
  • 4-carboxybenzeneboronic acid pinacol ester
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoicacid
  • EN300-99184
  • CS-W000887
  • (4-carboxyphenyl)boronic acid, pinacol ester
  • 4-Carboxylphenylboronic acid pinacol ester,98%
物化性质
实验特性
LogP 1.68400
PSA 55.76000
折射率 1.521
水溶性 不溶
沸点 379.7°C at 760 mmHg
熔点 228-231 °C (lit.)
闪点 183.4±23.2 °C
颜色与性状 固体
溶解性 未确定
密度 1.15
计算特性
精确分子量 248.12200
氢键供体数量 1
氢键受体数量 4
可旋转化学键数量 2
同位素质量 248.122
重原子数量 18
复杂度 316
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)
互变异构体数量
表面电荷 0
拓扑分子极性表面积 55.8
海关数据
海关编码 2931900090
海关数据

中国海关编码:

2931900090

概述:

2931900090. 其他有机-无机化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:AB(入境货物通关单,出境货物通关单). 最惠国关税:6.5%. 普通关税:30.0%

Summary:

2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

专业数据库参考
PubChemId 2734621
参考资料
Reaxys RN 7762531
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