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化合物简介
基本信息
CAS:141103-93-7
中文别名:
英文别名:4-Methyl-3,4-Dihydro-2H-1,4-Benzoxazine-7-Carbaldehyde;2H-1,4-Benzoxazine-7-carboxaldehyde,3,4-dihydro-4-methyl;
分子式:C10H11NO2
分子量:177.2
精确质量:177.079
Psa:29.54
Logp:1.3927
中文别名:
英文别名:4-Methyl-3,4-Dihydro-2H-1,4-Benzoxazine-7-Carbaldehyde;2H-1,4-Benzoxazine-7-carboxaldehyde,3,4-dihydro-4-methyl;
分子式:C10H11NO2
分子量:177.2
精确质量:177.079
Psa:29.54
Logp:1.3927
编号系统
MDL号:MFCD02681912
物化性质
密度:1.181g/cm3
沸点:336.5ºC at 760mmHg
熔点:53ºC
闪点:157.3ºC
折射率:1.587
蒸汽压:0.000112mmHg at 25°C
沸点:336.5ºC at 760mmHg
熔点:53ºC
闪点:157.3ºC
折射率:1.587
蒸汽压:0.000112mmHg at 25°C
安全信息
安全说明:S24/25
海关编码:2934999090
海关编码:2934999090
生产方法及用途
合成路线
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参考文献
MERCK SHARP and DOHME CORP.; KOZLOWSKI, Joseph A.; ROSENBLUM, Stuart B.; COBURN, Craig A.; SHANKAR, Bandarpalle, B.; ANILKUMAR, G., Nair; CHEN, Lei; DWYER, Michael, P.; JIANG, Yueheng; KEERTIKAR, Kartik, M.; LAVEY, Brian, J.; SELYUTIN, Oleg, B.; TONG, Ling; WONG, Michael; YANG, De-Yi; YU, Wensheng; ZHOU, Guowei; WU, Hao; HU, Bin; ZHONG, Bin; SUN, Fei; JI, Tao; SHEN, Changmao; RIZVI, Razia; ZENG, Qingbei Patent: WO2012/41014 A1, 2012 ; Location in patent: Page/Page column 236-237 ;
上游原料
下游产品
图谱
13C NMR : Predict

1H NMR : Predict
