HCID60139756

(5-Chlorobenzo[b]thiophen-2-yl)boronic acid

(5-chloro-1-benzothiophen-2-yl)boronic acid

C8H6BClO2S212.46 g/molCAS 867381-22-4

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IDENTITY

结构与身份

标准SMILES: OB(O)c1cc2cc(Cl)ccc2s1
InChIKey: YNTMDEYDNLWCLF-UHFFFAOYSA-N
分子式: C8H6BClO2S
平均分子量: 212.46 g/mol
单同位素质量: 211.9870085

COMPUTED

结构计算性质

已同步

极性表面积: 68.7 Å²
氢键供体: 2
氢键受体: 3
可旋转键: 1
重原子: 13
形式电荷: 0
复杂度: 193

ALIASES

名称与别名

共 15 条

867381-22-4(5-Chlorobenzo[b]thiophen-2-yl)boronic acid5-chlorobenzo[b]thiophen-2-ylboronic acid(5-Chloro-1-benzothiophen-2-yl)boronic acidMFCD11110416(5-Chlorobenzo[b]thiophen-2-yl)boronicacidSCHEMBL2205839DTXSID60733680YNTMDEYDNLWCLF-UHFFFAOYSA-NAKOS011560075DB-353477CS-0252792EN300-61609(5-Chloro-benzo[b]thiophen-2-yl)-boronic acidZ969202862

REACTIONS

参与反应

2 条

uspto-grants-2008_11 · 10.6084/m9.figshare.5104873.v1 · US07449481B2

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uspto-grants-2011_07 · 10.6084/m9.figshare.5104873.v1 · US07981907B2

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