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化合物简介
A metabolite of Temozolomide, an antineoplastic.
基本信息
CAS:3413-72-7
中文别名:
英文别名:5-Monomethyltriazenoimidazole-4-carboxamide;(5E)-5-(methylaminohydrazinylidene)imidazole-4-carboxamide;5-(3-Monomethyl-1-triazeno)imidazole-4-carboxamide;5-(3-Methyl-1-triazeno)imidazole-4-carboxamide;1H-Imidazole-4-carboxamide,5-(3-methyl-1-triazenyl);5-(3-methyltriazen-1-yl)imidazole-4-carboxamide;Imidazole-4-carboxamide,5-(3-methyl-1-triazeno);
分子式:C5H8N6O
分子量:168.157
精确质量:168.076
Psa:108.52
Logp:0.8179
中文别名:
英文别名:5-Monomethyltriazenoimidazole-4-carboxamide;(5E)-5-(methylaminohydrazinylidene)imidazole-4-carboxamide;5-(3-Monomethyl-1-triazeno)imidazole-4-carboxamide;5-(3-Methyl-1-triazeno)imidazole-4-carboxamide;1H-Imidazole-4-carboxamide,5-(3-methyl-1-triazenyl);5-(3-methyltriazen-1-yl)imidazole-4-carboxamide;Imidazole-4-carboxamide,5-(3-methyl-1-triazeno);
分子式:C5H8N6O
分子量:168.157
精确质量:168.076
Psa:108.52
Logp:0.8179
编号系统
UNII:PYY6H17XIV
物化性质
密度:1.66g/cm3
沸点:306.7ºC at 760mmHg
闪点:139.3ºC
折射率:1.741
沸点:306.7ºC at 760mmHg
闪点:139.3ºC
折射率:1.741
安全信息
海关编码:2934999090
生产方法及用途
合成路线
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
