HCID297050

3-Bromo-2-nitro-benzo(b)thiophene

3-bromo-2-nitro-1-benzothiophene

C8H4BrNO2S258.09 g/molCAS 17402-78-7

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IDENTITY

结构与身份

标准SMILES: O=[N+]([O-])c1sc2ccccc2c1Br
InChIKey: NEVPNAJUHZJMLO-UHFFFAOYSA-N
分子式: C8H4BrNO2S
平均分子量: 258.09 g/mol
单同位素质量: 256.91461

COMPUTED

结构计算性质

等待补全

XLogP: 3.8
极性表面积: 74.1 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 0
重原子: 13
形式电荷: 0
复杂度: 221

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 23 条

3-Bromo-2-nitro-benzo[b]thiophene3-Bromo-2-nitro-benzo(b)thiopheneRefChem:498512683-551-517402-78-73-bromo-2-nitro-1-benzothiophene3-bromo-2-nitrobenzo[b]thiopheneBenzo[b]thiophene, 3-bromo-2-nitro-MFCD002301003-Bromo-2-nitrobenzothiophene3-bromo-2-nitro-benzothiopheneNSC167741SCHEMBL1514331DTXSID803048562-nitro-3-bromobenzo(b)thiopheneNEVPNAJUHZJMLO-UHFFFAOYSA-NSTK387230AKOS004903207NSC-167741CS-0056219

REACTIONS

参与反应

9 条

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

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uspto-grants-2008_06 · 10.6084/m9.figshare.5104873.v1 · US07384934B2

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uspto-grants-2008_06 · 10.6084/m9.figshare.5104873.v1 · US07384934B2

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

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uspto-grants-2007_05 · 10.6084/m9.figshare.5104873.v1 · US07214673B2

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uspto-grants-2007_05 · 10.6084/m9.figshare.5104873.v1 · US07214673B2

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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uspto-grants-2015_06 · 10.6084/m9.figshare.5104873.v1 · US09059412B2

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