18672-07-6

• 常用中文名：Ethyl 2-(4-cyanophenoxy)-2-methylpropanoate
• 常用英文名：Ethyl 2-(4-cyanophenoxy)-2-methylpropanoate
• CAS号：18672-07-6
• 分子式：C₁₃H₁₅NO₃
• 分子量：233.26300
• 发布时间：2016-06-07 16:52:42
• 更新时间：2024-04-02 12:02:07

名称

• 英文名: Ethyl 2-(4-cyanophenoxy)-2-methylpropanoate

物化性质

• 密度: 1.11g/cm3
• 沸点: 351ºC at 760 mmHg
• 分子式: C₁₃H₁₅NO₃
• 分子量: 233.26300
• 闪点: 153.3ºC
• 精确质量: 233.10500
• PSA: 59.32000
• LogP: 2.27878
• 蒸汽压: 4.24E-05mmHg at 25°C
• 折射率: 1.513

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : UA2458290 CHEMICAL NAME : Propanoic acid, 2-(4-cyanophenoxy)-2-methyl-, ethyl ester CAS REGISTRY NUMBER : 18672-07-6 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C13-H15-N-O3 MOLECULAR WEIGHT : 233.29 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD - Lethal dose ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : >2 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : APFRAD Annales Pharmaceutiques Francaises. (SPPIF, B.P.22, F-41353 Vineuil, France) V.1- 1943- Volume(issue)/page/year: 47,16,1989

合成路线

600-00-0 767-00-0 ~99% 18672-07-6

文献：SMITHKLINE BEECHAM CORPORATION Patent: WO2005/49578 A1, 2005 ; Location in patent: Page/Page column 59 ; WO 2005/049578 A1

2052-01-9 767-00-0 ~96% 18672-07-6

文献：SMITHKLINE BEECHAM CORPORATION Patent: WO2005/37804 A1, 2005 ; Location in patent: Page/Page column 11 ; WO 2005/037804 A1

637-07-0 557-21-1 ~49% 18672-07-6

文献：Chobanian, Harry R.; Fors, Brett P.; Lin, Linus S. Tetrahedron Letters, 2006 , vol. 47, # 19 p. 3303 - 3305

67-66-3 767-00-0 67-64-1 ~% 18672-07-6

文献：Witiak; Ho; Hackney; Connor Journal of medicinal chemistry, 1968 , vol. 11, # 5 p. 1086 - 1089