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化合物简介
1-[4-(Methylthio)phenyl]-1,4-pentanedione, can be used as an intermediate for the synthesis of class of pyrrole derivatives, having analgesic/anti-inflammatory activity, such as Saroglitazar.
基本信息
CAS：189501-33-5
中文别名：
英文别名：1-[4-(methylsulfanyl)phenyl]-1,4-pentanedione;1-[4-(methylthio)phenyl]pentane-1,4-dione;1-(4-methylthiophenyl)-1,4-pentanedione;methylsulfanylphenylpentanedione;
分子式：C12H14O2S
分子量：222.303
精确质量：222.071
Psa：59.44
Logp：2.9604
中文别名：
英文别名：1-[4-(methylsulfanyl)phenyl]-1,4-pentanedione;1-[4-(methylthio)phenyl]pentane-1,4-dione;1-(4-methylthiophenyl)-1,4-pentanedione;methylsulfanylphenylpentanedione;
分子式：C12H14O2S
分子量：222.303
精确质量：222.071
Psa：59.44
Logp：2.9604
编号系统
MDL号：MFCD08056601
物化性质
安全信息
海关编码：2930909090
生产方法及用途
合成路线
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参考文献
Battilocchio, Claudio; Poce, Giovanna; Alfonso, Salvatore; Porretta, Giulio Cesare; Consalvi, Sara; Sautebin, Lidia; Pace, Simona; Rossi, Antonietta; Ghelardini, Carla; Di Cesare Mannelli, Lorenzo; Schenone, Silvia; Giordani, Antonio; Di Francesco, Luigia; Patrignani, Paola; Biava, Mariangela Bioorganic and Medicinal Chemistry, 2013 , vol. 21, # 13 p. 3695 - 3701
上游原料
下游产品
图谱
13C NMR : Predict
1H NMR : Predict
