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13655-52-2生产厂家

13655-52-2价格

13655-52-2

13655-52-2结构式
13655-52-2结构式
  • 常用中文名:阿普洛尔
  • 常用英文名:Alprenolol
  • CAS号:13655-52-2
  • 分子式:C15H23NO2
  • 分子量:249.34900
  • 相关类别: 原料药 循环系统用药 抗心律失常药
  • 发布时间:2018-07-21 23:06:12
  • 更新时间:2024-01-04 14:23:14
  • Alprenolol是一个非选择性的beta阻断剂,也是5-HT1A受体的拮抗剂。

化源商城直购

中文名 阿普洛尔
英文名 alprenolol
中文别名 1-(异丙基氨基)-3-(2-烯丙基苯氧基)-2-丙醇
心得舒
英文别名 Alpheprol
Alprenolol
ALLPRENOLOL
密度 1.007g/cm3
沸点 383.4ºC at 760mmHg
熔点 57.5°C
分子式 C15H23NO2
分子量 249.34900
闪点 185.7ºC
精确质量 249.17300
PSA 41.49000
LogP 2.54370
蒸汽压 1.46E-06mmHg at 25°C
折射率 1.5250 (estimate)
储存条件 库房通风低温干燥,与食品原料分开存放
计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:2

3.氢键受体数量:3

4.可旋转化学键数量:8

5.互变异构体数量:无

6.拓扑分子极性表面积:41.5

7.重原子数量:18

8.表面电荷:0

9.复杂度:231

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: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:1

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UA5350000
CHEMICAL NAME :
2-Propanol, 1-(o-allylphenoxy)-3-(isopropylamino)-
CAS REGISTRY NUMBER :
13655-52-2
LAST UPDATED :
199606
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C15-H23-N-O2
MOLECULAR WEIGHT :
249.39
WISWESSER LINE NOTATION :
1Y1&M1YQ1OR B2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Human - woman
DOSE/DURATION :
210 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
UGLAAD Ugeskrift for Laeger. Doctor's Weekly. (Almindelige Danske Laegeforening, Esplanaden 8C4, 1045 Copenhagen K, Denmark) V.1- 1839- Volume(issue)/page/year: 139,2817,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 18,151,1983
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
20 mg/kg
TOXIC EFFECTS :
Autonomic Nervous System - sympathomimetic
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 27,1022,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
184 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 8,137,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
102 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 8,137,1974

危害码 (欧洲) T: Toxic;
风险声明 (欧洲) R23/24/25
安全声明 (欧洲) 36/37/39-45
危险品运输编码 UN 3249
包装等级 III
危险类别 6.1(b)