4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one

• 常用名: 4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one
• 英文名: 4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one
• CAS号: 104940-88-7
• 分子量: 179.21900
• 密度: 1.06g/cm3
• 沸点: 330.5ºC at 760 mmHg
• 分子式: C₉H₁₃N₃O
• 熔点: N/A
• 闪点: 153.7ºC

名称

• 英文名: 4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-one

物理化学性质

• 密度: 1.06g/cm3
• 沸点: 330.5ºC at 760 mmHg
• 分子式: C₉H₁₃N₃O
• 分子量: 179.21900
• 闪点: 153.7ºC
• 精确质量: 179.10600
• PSA: 47.78000
• LogP: 1.36400
• InChIKey: RGGXVDKXZOPPIV-UHFFFAOYSA-N
• SMILES: C=C(C(=O)C(C)(C)C)n1cncn1
• 蒸汽压: 0.000166mmHg at 25°C
• 折射率: 1.532

靶点实验

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实验名称：Antifungal activity against Aspergillus fumigatus was determined in vitro 来源：ChEMBL 靶标：Aspergillus fumigatus External Id：CHEMBL649170

实验名称：Antifungal activity against Trichophyton asteroides was determined in vitro 来源：ChEMBL 靶标：Trichophyton benhamiae External Id：CHEMBL856998

实验名称：Antifungal activity against Candida albicans was determined in vitro 来源：ChEMBL 靶标：Candida albicans External Id：CHEMBL659115

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