HCID80611

4,5-Dibromothenoic acid

4,5-dibromothiophene-2-carboxylic acid

C5H2Br2O2S285.94 g/molCAS 6324-10-3

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IDENTITY

结构与身份

标准SMILES: O=C(O)c1cc(Br)c(Br)s1
InChIKey: USFXRYVNRUMABJ-UHFFFAOYSA-N
分子式: C5H2Br2O2S
平均分子量: 285.94 g/mol
单同位素质量: 283.81423

COMPUTED

结构计算性质

等待补全

XLogP: 3.2
极性表面积: 65.5 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 1
重原子: 10
形式电荷: 0
复杂度: 153

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 39 条

4,5-Dibromothenoic acidDTXSID20212628EINECS 228-683-2NSC 30091RefChem:507638DTXCID50135119228-683-24,5-Dibromothiophene-2-carboxylic acid6324-10-34,5-Dibromo-2-thiophenecarboxylic acidMFCD000396824,5-DIBROMOTHIOPHENE-2-CARBOXYLICACIDNSC300914,5-Dibromo-thiophene-2-carboxylic acidMaybridge1_002274SCHEMBL899479CHEMBL4129835HMS547P08STR05322NSC-30091

REACTIONS

相关反应

33 条

uspto-grants-1993_09 · 10.6084/m9.figshare.5104873.v1 · US05246948

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

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uspto-grants-1995_02 · 10.6084/m9.figshare.5104873.v1 · US05389658

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uspto-grants-1991_10 · 10.6084/m9.figshare.5104873.v1 · US05059693

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uspto-grants-1994_03 · 10.6084/m9.figshare.5104873.v1 · US05290802

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uspto-grants-2001_01 · 10.6084/m9.figshare.5104873.v1 · US06174883B1

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uspto-grants-1999_07 · 10.6084/m9.figshare.5104873.v1 · US05919809

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

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