132-93-4

• 常用中文名：青霉素B
• 常用英文名：phenethicillin potassium
• CAS号：132-93-4
• 分子式：C₁₇H₁₉KN₂O₅S
• 分子量：402.50600
• 相关类别： 原料药 抗生素类药物 青霉素类药
• 发布时间：2018-08-14 19:37:18
• 更新时间：2024-01-13 13:50:06

名称

• 中文名: 苯氧乙基青霉素钾
• 英文名: phenethicillin potassium
• 中文别名: 苯乙青霉素; 青霉素152; 青霉素B
• 英文别名: penova; brl152; darcil; brocsil; PHENETHICILLIN POTASSIUM SALT; alpen; broxil; EINECS 205-084-4; maxipen; potassium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenoxypropanamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; potassium phenethicillin; (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenoxy propyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid monopotassium salt; pheneticillin potassium; cvk; pen200; pensig

物化性质

• 沸点: 673.9ºC at 760 mmHg
• 分子式: C₁₇H₁₉KN₂O₅S
• 分子量: 402.50600
• 闪点: 361.3ºC
• 精确质量: 402.06500
• PSA: 124.07000
• LogP: 0.07970
• 蒸汽压: 4.44E-19mmHg at 25°C
• 计算化学:

  1、 疏水参数计算参考值（XlogP）：

  2、 氢键供体数量：1

  3、 氢键受体数量：5

  4、 可旋转化学键数量：5

  5、 互变异构体数量：2

  6、 拓扑分子极性表面积（TPSA）：98.8

  7、 重原子数量：26

  8、 表面电荷：0

  9、 复杂度：582

  10、同位素原子数量：0

  11、确定原子立构中心数量：3

  12、不确定原子立构中心数量：1

  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：2

毒性和生态

毒理学数据: 急性毒性数据： 大鼠腹腔LD50：1750mg/kg 小鼠经口LD50：>2mg/kg 小鼠腹腔LD50：1896mg/kg 小鼠静脉LD50:312mg/kg 狗静脉LD50：>103mg/kg 豚鼠静脉LD50：324mg/kg CHEMICAL IDENTIFICATION RTECS NUMBER : XH9350000 CHEMICAL NAME : 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(2- phenoxypropionamido)-, monopotassium salt CAS REGISTRY NUMBER : 132-93-4 LAST UPDATED : 199707 DATA ITEMS CITED : 6 MOLECULAR FORMULA : C17-H19-N2-O5-S.K MOLECULAR WEIGHT : 402.54 WISWESSER LINE NOTATION : T45 ANV ESTJ CMVY1&OR& F1 F1 GVQ &-KA- HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 1750 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 12,751,1962 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 : YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 85,289,1965 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1896 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ABANAE Antibiotics Annual. (New York, NY) 1953-60. For publisher information, see AMACCQ. Volume(issue)/page/year: 7,119,1959/1960 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 312 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ABANAE Antibiotics Annual. (New York, NY) 1953-60. For publisher information, see AMACCQ. Volume(issue)/page/year: 7,119,1959/1960 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Mammal - dog DOSE/DURATION : >103 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ABANAE Antibiotics Annual. (New York, NY) 1953-60. For publisher information, see AMACCQ. Volume(issue)/page/year: 7,119,1959/1960 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : 324 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : RPOBAR Research Progress in Organic-Biological and Medicinal Chemistry. (New York, NY) V.1-3, 1964-72. Discontinued. Volume(issue)/page/year: 2,311,1970

安全

• WGK德国: 2
• RTECS号: XH9700000