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[(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride

更新时间:2025-08-29 00:39:05

[(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride结构式
[(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride结构式
委托求购
常用名 [(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride 英文名 [(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride
CAS号 117983-13-8 分子量 287.78600
密度 N/A 沸点 310.8ºC at 760 mmHg
分子式 C13H22ClN3O2 熔点 N/A
MSDS N/A 闪点 141.8ºC

 名称

英文名 [(Z)-[1-[[(E)-4,4-dimethylpent-2-enoxy]methyl]-3-methylimidazol-2-ylidene]methyl]-oxoazanium,chloride

 物理化学性质

沸点 310.8ºC at 760 mmHg
分子式 C13H22ClN3O2
分子量 287.78600
闪点 141.8ºC
精确质量 287.14000
PSA 48.52000
LogP 2.99050
InChIKey PIQJDEVYMFYSFZ-IPZCTEOASA-N
SMILES C[n+]1ccn(COCC=CC(C)(C)C)c1C=NO.[Cl-]
蒸汽压 0.000587mmHg at 25°C

 上下游产品

上游产品  2

下游产品  0

 靶点实验

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实验名称:Partition coefficient (logD7.6)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL630220
实验名称:Significant protection against the lethal effects of soman, by administering compound...
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL739704
实验名称:Number of surviving mice was calculated after the administration of 11.2 mg/kg of atr...
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL879316
实验名称:Number of surviving mice was calculated after the administration of 11.2 mg/kg of atr...
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL739614
实验名称:Ionization constant (pKa)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL632263
实验名称:Number of surviving mice was calculated after the administration of 25 mg/kg compound...
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL739616
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