165611-01-8

• 常用中文名：3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine
• 常用英文名：3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine
• CAS号：165611-01-8
• 分子式：C₁₃H₉ClN₄O₂
• 分子量：288.68900
• 发布时间：2016-01-28 14:08:09
• 更新时间：2024-10-05 10:57:23

名称

• 英文名: 5-(chloromethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
• 英文别名: 3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine; 5-chloromethyl-7-phenyl-isoxazolo[4,5-d]pyrimidine-3-carboxamide; Isoxazolo(4,5-d)pyrimidine-3-carboxamide,5-(chloromethyl)-7-phenyl

物化性质

• 密度: 1.46g/cm3
• 沸点: 485.7ºC at 760mmHg
• 分子式: C₁₃H₉ClN₄O₂
• 分子量: 288.68900
• 闪点: 247.6ºC
• 精确质量: 288.04100
• PSA: 95.89000
• LogP: 3.00670
• 蒸汽压: 1.38E-09mmHg at 25°C
• 折射率: 1.671

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : NY3400892 CHEMICAL NAME : Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 5-(chloromethyl)-7-phenyl- CAS REGISTRY NUMBER : 165611-01-8 LAST UPDATED : 199606 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C13-H9-Cl-N4-O2 MOLECULAR WEIGHT : 288.71 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill 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 : FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 50,183,1995

合成路线

76390-64-2 107-14-2 ~82% 165611-01-8

文献：Wagner, Edwin; Al-Kadasi, Kamal; Becan, Lilianna; Sawka-Dobrowolska, Wanda Journal of Heterocyclic Chemistry, 2010 , vol. 47, # 3 p. 677 - 682