HCID69976

2,4,5-Trimethylimidazole

2,4,5-trimethyl-1H-imidazole

C6H10N2110.16 g/molCAS 822-90-2

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IDENTITY

结构与身份

标准SMILES: Cc1nc(C)c(C)[nH]1
InChIKey: PTBPTNCGZUOCBK-UHFFFAOYSA-N
分子式: C6H10N2
平均分子量: 110.16 g/mol
单同位素质量: 110.08439833

COMPUTED

结构计算性质

等待补全

XLogP: 1.3
极性表面积: 28.7 Å²
氢键供体: 1
氢键受体: 1
可旋转键: 0
重原子: 8
形式电荷: 0
复杂度: 82

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 29 条

822-90-22,4,5-TrimethylimidazoleR42O298O4WDTXSID30231623RefChem:82050DTXCID601541142,4,5-TMI212-507-62,4,5-Trimethyl-1H-imidazole1H-Imidazole,2,4,5-trimethyl-1H-Imidazole, 2,4,5-trimethyl-EINECS 212-507-6SCHEMBL64073UNII-R42O298O4W2,4,5-trimethyl-1H-imidazolimidazole, 2,4,5-trimethyl-SCHEMBL3395410SCHEMBL5602510SCHEMBL89259562,4,5-Trimethyl-1H-imidazole #

REACTIONS

参与反应

5 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 (9/10) · 10.1039/C8SC04228D

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uspto-grants-1987_11 · 10.6084/m9.figshare.5104873.v1 · US04709043

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uspto-grants-1985_12 · 10.6084/m9.figshare.5104873.v1 · US04556665

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uspto-grants-2006_01 · 10.6084/m9.figshare.5104873.v1 · US06984646B2

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