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1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine

更新时间:2025-09-16 10:11:47

1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine结构式
1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine结构式
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常用名 1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine 英文名 1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine
CAS号 32787-80-7 分子量 217.18400
密度 1.44g/cm3 沸点 425.1ºC at 760 mmHg
分子式 C9H7N5O2 熔点 N/A
MSDS N/A 闪点 210.9ºC

 名称

英文名 (E)-1-(3-nitrophenyl)-N-(4H-1,2,4-triazol-4-yl)methanimine

 物理化学性质

密度 1.44g/cm3
沸点 425.1ºC at 760 mmHg
分子式 C9H7N5O2
分子量 217.18400
闪点 210.9ºC
精确质量 217.06000
PSA 88.89000
LogP 1.59170
InChIKey FAUGLCGCOYUPKR-LFYBBSHMSA-N
SMILES O=[N+]([O-])c1cccc(C=Nn2cnnc2)c1
折射率 1.69

 合成线路

~%

1-(3-nitrophenyl)-N-(1,2,4-triazol-4-yl)methanimine结构式

1-(3-nitropheny...

32787-80-7

文献:Letunov, V. I. Journal of Organic Chemistry USSR (English Translation), 1984 , vol. 20, p. 145 - 149 Zhurnal Organicheskoi Khimii, 1984 , vol. 20, # 1 p. 162 - 166

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 靶点实验

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实验名称:A screen for small molecule inhibitors of the human deubiquitinating enzyme, UCH37
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:ubiquitin C-terminal hydrolase UCH37 [Homo sapiens]
External Id:HMS937_MLP
实验名称:A screen for compounds that inhibit growth of Escherichia coli
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1158_MLP
实验名称:A screen for compounds that are lethal to S. aureus RN4220
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1364-MLP_WT
实验名称:A screen for compounds that are lethal to S. aureus RN4220 with the processive glycos...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1364-MLP_ugtP
实验名称:High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1149-MLP
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