HCID20335

1,3-Dimethylimidazolium

1,3-dimethylimidazol-1-ium

C5H9N2+97.14 g/molCAS 45470-32-4

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IDENTITY

结构与身份

标准SMILES: Cn1cc[n+](C)c1
InChIKey: HVVRUQBMAZRKPJ-UHFFFAOYSA-N
分子式: C5H9N2+
平均分子量: 97.14 g/mol
单同位素质量: 97.0765733

COMPUTED

结构计算性质

等待补全

XLogP: 0.1
极性表面积: 8.8 Å²
氢键供体: 0
氢键受体: 0
可旋转键: 0
重原子: 7
形式电荷: 1
复杂度: 55

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 18 条

1,3-DIMETHYLIMIDAZOLIUM1,3-dimethyl-1H-imidazol-3-ium45470-32-4DTXSID1048095CHEBI:61322RefChem:72736DTXCID20280661,3-dimethylimidazol-1-ium[dmim]SCHEMBL35176SCHEMBL6400304SCHEMBL6400386CHEMBL1229272SCHEMBL204953821,3-dimethylimidazolenyl carbeneAKOS032954361CS-0184054Q27131029

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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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 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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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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