HCID4198743

5-Cyanothiophene-2-boronic acid

(5-cyanothiophen-2-yl)boronic acid

C5H4BNO2S152.97 g/molCAS 305832-67-1

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IDENTITY

结构与身份

标准SMILES: N#Cc1ccc(B(O)O)s1
InChIKey: ZEOMEPSYIIQIND-UHFFFAOYSA-N
分子式: C5H4BNO2S
平均分子量: 152.97 g/mol
单同位素质量: 153.0055797

COMPUTED

结构计算性质

等待补全

极性表面积: 92.5 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 1
重原子: 10
形式电荷: 0
复杂度: 166

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 28 条

5-Cyanothiophene-2-boronic acid305832-67-1(5-cyanothiophen-2-yl)boronic AcidDTXSID40400742RefChem:535088DTXCID90351598608-502-75-cyanothiophen-2-ylboronic acidMFCD02094029Boronic acid, B-(5-cyano-2-thienyl)-(5-cyano-2-thienyl)boronic acidC5H4BNO2SBoronic acid, (5-cyano-2-thienyl)-5-CYANO-2-THIENYLBORONIC ACID5-(dihydroxyboranyl)thiophene-2-carbonitrileSCHEMBL129170CHEMBL1246632-cyanothiophene-5-boronic acid(5-cyanothiophen-2-yl)boronicAcidZB1457

REACTIONS

相关反应

21 条

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09433618B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2010_08 · 10.6084/m9.figshare.5104873.v1 · US07786132B2

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uspto-grants-2015_08 · 10.6084/m9.figshare.5104873.v1 · US09108970B2

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uspto-grants-2016_04 · 10.6084/m9.figshare.5104873.v1 · US09315462B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09181255B2

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