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化合物简介
基本信息
CAS:39832-36-5
中文别名:
英文别名:1-Ethyl-3,7-dimethyl-xanthine;1H-Purine-2,6-dione,1-ethyl-3,7-dihydro-3,7-dimethyl;Theobromine,1-ethyl;1-ethyl-3,7-dimethyl-3,7-dihydro-purine-2,6-dione;1-Ethyl-3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione;1-Aethyl-3,7-dimethyl-3,7-dihydro-purin-2,6-dion;1-Ethyl-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione;1-Ethyl theobromine;3,7-dimethyl-1-ethyl-xanthine;ethyl-1 dimethyl-3,7-xanthine;
分子式:C9H12N4O2
分子量:208.217
精确质量:208.096
Psa:61.82
Logp:-0.5464
中文别名:
英文别名:1-Ethyl-3,7-dimethyl-xanthine;1H-Purine-2,6-dione,1-ethyl-3,7-dihydro-3,7-dimethyl;Theobromine,1-ethyl;1-ethyl-3,7-dimethyl-3,7-dihydro-purine-2,6-dione;1-Ethyl-3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione;1-Aethyl-3,7-dimethyl-3,7-dihydro-purin-2,6-dion;1-Ethyl-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione;1-Ethyl theobromine;3,7-dimethyl-1-ethyl-xanthine;ethyl-1 dimethyl-3,7-xanthine;
分子式:C9H12N4O2
分子量:208.217
精确质量:208.096
Psa:61.82
Logp:-0.5464
编号系统
UNII:9T24XXI18T
物化性质
密度:1.39g/cm3
沸点:420.9ºC at 760 mmHg
闪点:208.4ºC
折射率:1.656
沸点:420.9ºC at 760 mmHg
闪点:208.4ºC
折射率:1.656
安全信息
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
