14437-41-3

• 常用中文名：氯碘沙尼
• 常用英文名：Benzamide,2-(acetyloxy)-N-(4-chlorophenyl)-3,5-diiodo-
• CAS号：14437-41-3
• 分子式：C₁₅H₁₀ClI₂NO₃
• 分子量：541.50700
• 发布时间：2018-06-11 18:47:25
• 更新时间：2024-01-30 14:40:36

名称

• 中文名: 氯碘沙尼
• 英文名: [2-[(4-chlorophenyl)carbamoyl]-4,6-diiodophenyl] acetate
• 英文别名: 2-Acetoxy-3,5-diiodo-4'-chlorobenzanilide; Tremerad; CN 59,567; CLIOXANIDE; 2-Acetoxy-4'-chlor-3.5-diiod-benzanilid; 2-Acetoxy-4'-chloro-3,5-di-iodobenzanilide; 4'-Chloro-3,5-diiodosalicylanilide acetate; SYD 230

物化性质

• 密度: 2.066g/cm3
• 沸点: 496.8ºC at 760mmHg
• 分子式: C₁₅H₁₀ClI₂NO₃
• 分子量: 541.50700
• 闪点: 254.3ºC
• 精确质量: 540.84400
• PSA: 55.40000
• LogP: 4.79980
• 蒸汽压: 5.24E-10mmHg at 25°C
• 折射率: 1.714
• 储存条件: 库房低温,通风,干燥
• 计算化学:

  1.疏水参数计算参考值（XlogP）:4.4

  2.氢键供体数量:1

  3.氢键受体数量:3

  4.可旋转化学键数量:4

  5.互变异构体数量:2

  6.拓扑分子极性表面积:55.4

  7.重原子数量:22

  8.表面电荷:0

  9.复杂度:416

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : VN7885000 CHEMICAL NAME : Salicylanilide, 4'-chloro-3,5-diiodo-, acetate ester CAS REGISTRY NUMBER : 14437-41-3 LAST UPDATED : 199701 DATA ITEMS CITED : 6 MOLECULAR FORMULA : C15-H10-Cl-I2-N-O3 MOLECULAR WEIGHT : 541.51 WISWESSER LINE NOTATION : IR CI DOV1 EVMR DG HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : >5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : AUVJA2 Australian Veterinary Journal. (Australian Veterinary Assoc., Executive Director, 134-136 Hampden Road, Artarmon, N.S.W., Australia) V.2- 1927- Volume(issue)/page/year: 46,297,1970 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : >5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : AUVJA2 Australian Veterinary Journal. (Australian Veterinary Assoc., Executive Director, 134-136 Hampden Road, Artarmon, N.S.W., Australia) V.2- 1927- Volume(issue)/page/year: 46,297,1970 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 720 mg/kg TOXIC EFFECTS : Behavioral - ataxia Lungs, Thorax, or Respiration - acute pulmonary edema Nutritional and Gross Metabolic - body temperature increase REFERENCE : AUVJA2 Australian Veterinary Journal. (Australian Veterinary Assoc., Executive Director, 134-136 Hampden Road, Artarmon, N.S.W., Australia) V.2- 1927- Volume(issue)/page/year: 46,297,1970 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Mammal - domestic DOSE/DURATION : 414 mg/kg TOXIC EFFECTS : Behavioral - ataxia Lungs, Thorax, or Respiration - acute pulmonary edema Nutritional and Gross Metabolic - body temperature increase REFERENCE : AUVJA2 Australian Veterinary Journal. (Australian Veterinary Assoc., Executive Director, 134-136 Hampden Road, Artarmon, N.S.W., Australia) V.2- 1927- Volume(issue)/page/year: 46,297,1970 ** OTHER MULTIPLE DOSE TOXICITY DATA ** TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Mammal - cattle DOSE/DURATION : 250 mg/kg/5D-I TOXIC EFFECTS : Nutritional and Gross Metabolic - weight loss or decreased weight gain Related to Chronic Data - death REFERENCE : AUVJA2 Australian Veterinary Journal. (Australian Veterinary Assoc., Executive Director, 134-136 Hampden Road, Artarmon, N.S.W., Australia) V.2- 1927- Volume(issue)/page/year: 46,297,1970

合成路线

14437-46-8 108-24-7 ~% 14437-41-3

文献：Dahlgren, Markus K.; Kauppi, Anna M.; Olsson, Ing-Marie; Linusson, Anna; Elofsson, Mikael Journal of Medicinal Chemistry, 2007 , vol. 50, # 24 p. 6177 - 6188