[(E)-[1-methyl-3-(3-methylbutoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium,chloride

• 常用名: [(E)-[1-methyl-3-(3-methylbutoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium,chloride
• 英文名: [(E)-[1-methyl-3-(3-methylbutoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium,chloride
• CAS号: 117941-49-8
• 分子量: 261.74800
• 密度: N/A
• 沸点: 274.7ºC at 760 mmHg
• 分子式: C₁₁H₂₀ClN₃O₂
• 熔点: N/A
• 闪点: 119.9ºC

名称

• 英文名: [(E)-[1-methyl-3-(3-methylbutoxymethyl)imidazol-2-ylidene]methyl]-oxoazanium,chloride

物理化学性质

• 沸点: 274.7ºC at 760 mmHg
• 分子式: C₁₁H₂₀ClN₃O₂
• 分子量: 261.74800
• 闪点: 119.9ºC
• 精确质量: 261.12400
• PSA: 48.52000
• LogP: 2.43430
• InChIKey: CJDDIPBDQJWUMQ-UHFFFAOYSA-N
• SMILES: CC(C)CCOCn1cc[n+](C)c1C=NO.[Cl-]
• 蒸汽压: 0.00531mmHg at 25°C

靶点实验

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实验名称：Dissociation constant (pKa) (in 0.1 M phosphate buffer) 来源：ChEMBL 靶标：N/A External Id：CHEMBL633261

实验名称：Number of surviving mice after the administration of compound and 11.2 mg/kg of atrop... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL743477

实验名称：Octanol buffer partition coefficient for 0.1M, at pH 7.6 in phosphate buffer 来源：ChEMBL 靶标：N/A External Id：CHEMBL643271

实验名称：Number of surviving mice after the administration of compound and 11.2 mg/kg of atrop... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL741609

实验名称：Compound was tested in mouse for significant protection against the lethal effects of... 来源：ChEMBL 靶标：N/A External Id：CHEMBL817314

实验名称：Number of surviving mice after the administration of compound and 11.2 mg/kg of atrop... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL743479

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