668970-91-0

• 常用中文名：4-乙炔基-3,5-二甲基异恶唑
• 常用英文名：4-ETHYNYL-3,5-DIMETHYL-ISOXAZOLE
• CAS号：668970-91-0
• 分子式：C₇H₇NO
• 分子量：121.13700
• 发布时间：2017-12-20 14:12:32
• 更新时间：2026-08-29 16:26:13

名称

• 中文名: 4-乙炔基-3,5-二甲基异恶唑
• 英文名: 4-Ethynyl-3,5-dimethyl-1,2-oxazole
• 中文别名: 4-乙基-3,5-二甲基异噁唑; 4-乙炔基-3,5-二甲基-1,2-恶唑
• 英文别名: 4-ethynyl-3,5-dimethylisoxazole; Isoxazole, 4-ethynyl-3,5-diMethyl; 4-ethynyl-3,5-dimethyl-1,2-oxazole; 4-ethynyl-3,5-dimethyl-soxazole

物化性质

• 分子式: C₇H₇NO
• 分子量: 121.13700
• 精确质量: 121.05300
• PSA: 26.03000
• LogP: 1.27270
• 储存条件: 2-8°C， 干燥

合成路线

1201657-82-0 ~80% 668970-91-0

文献：Hoffmann-La Roche Inc.; Alam, Muzaffar; Du Bois, Daisy Joe; Hawley, Ronald Charles; Bhagirath, Niala; Kennedy-Smith, Joshua; Wilhelm, Robert Stephen Patent: US2013/158049 A1, 2013 ; Location in patent: Paragraph 0261 ;

10557-85-4 ~% 668970-91-0

文献：Hoffmann-La Roche Inc.; Alam, Muzaffar; Du Bois, Daisy Joe; Hawley, Ronald Charles; Bhagirath, Niala; Kennedy-Smith, Joshua; Wilhelm, Robert Stephen Patent: US2013/158049 A1, 2013 ;

300-87-8 ~% 668970-91-0

文献：Naud, Sebastien; Westwood, Isaac M.; Faisal, Amir; Sheldrake, Peter; Bavetsias, Vassilios; Atrash, Butrus; Cheung, Kwai-Ming J.; Liu, Manjuan; Hayes, Angela; Schmitt, Jessica; Wood, Amy; Choi, Vanessa; Boxall, Kathy; Mak, Grace; Gurden, Mark; Valenti, Melanie; De Haven Brandon, Alexis; Henley, Alan; Baker, Ross; McAndrew, Craig; Matijssen, Berry; Burke, Rosemary; Hoelder, Swen; Eccles, Suzanne A.; Raynaud, Florence I.; Linardopoulos, Spiros; Van Montfort, Rob L. M.; Blagg, Julian Journal of Medicinal Chemistry, 2013 , vol. 56, # 24 p. 10045 - 10065

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