Benzoic acid, p-(butylamino)-,2-(2-(2-(2-(2-(2-(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)ethoxy) ethoxy)ethoxy)ethoxy)ethoxy)ethyl ester 苯佐那酯

CAS 104-31-4 MFCD00072060

化学结构图

104-31-4
SMILES: CCCCNc1ccc(C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc1

化学属性

Mol. FormulaC30H53NO11
Mol. Weight603.84
Appearance 无色或淡黄色澄明油状液体。能溶于除脂肪烃以外的多种有机溶剂，与水、乙醇、苯、乙醚等混溶。

别名和识别编码

Chemical NameBenzoic acid, p-(butylamino)-,2-(2-(2-(2-(2-(2-(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)ethoxy) ethoxy)ethoxy)ethoxy)ethoxy)ethyl ester
EC Number203-194-7
Synonym 2,5,8,11,14,17,20,23,26-NONAOXAOCTACOSAN-28-YL P-(BUTYLAMINO)-BENZOATE Benzoic acid, 4-(butylamino)-, 4-丁氨基苯甲酸九聚乙二醇单甲醚酯 ventussin tesalon ventussin-loz exangit tessalin p-(n)-butylaminobenzoesaeure-(nonaaethylenglykol-monomethylaether)-ester 对正丁氨基苯甲酸-2-(ω)-甲氧工-八乙氧基-乙酯 benzononantin p-(butylamino)-benzoicaci2-(2-(2-(2-(2-(2-(2-(2-(2-methoxyethoxy)ethoxy)e thoxy)ethoxy)ethoxy)ethoxy)ethoxy)ethoxy)ethylester 退嗽 tessalon 本佐那酯 4-(Butylamino)benzoicacid3,6,9,12,15,18,21,24,27-nonaoxao-ctacos-1-ylester 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl-4-butylaminobenzoate 苯佐那酯 benzoicacid,4-(butylamino)-,3,6,9,12,15,18,21,24,27-nonaoxaoctacos-1-yles BENZOIC ACID,4-(BUTYLAMINO)-,2,5,8,11,14,17,20,23,26-NONAOXAOCTACOS-28-YL ESTER benzononatine tessalon-ciba BENZONATATE polyethyleneglycol-p-n-butylaminobenzoatemethylester km65
CAS Number104-31-4
MDL NumberMFCD00072060
Chemical Name Translation苯佐那酯
Wiswesser Line Notation4MR DVO2O2O2O2O2O2O2O2O2O1
PubChem Substance ID7699
InChIInChI=1S/C30H53NO11/c1-3-4-9-31-29-7-5-28(6-8-29)30(32)42-27-26-41-25-24-40-23-22-39-21-20-38-19-18-37-17-16-36-15-14-35-13-12-34-11-10-33-2/h5-8,31H,3-4,9-27H2,1-2H3
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安全信息

RTECSDG4904500 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SMWOAS Schweizerische Medizinische Wochenschrift.  (Schwabe & Co.,
   Steintorst 13, 4010 Basel, Switzerland)  V.50-    1920-
   Volume(issue)/page/year: 86,94,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 7,372,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 5 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SMWOAS Schweizerische Medizinische Wochenschrift.  (Schwabe & Co.,
   Steintorst 13, 4010 Basel, Switzerland)  V.50-    1920-
   Volume(issue)/page/year: 86,94,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   SMWOAS Schweizerische Medizinische Wochenschrift.  (Schwabe & Co.,
   Steintorst 13, 4010 Basel, Switzerland)  V.50-    1920-
   Volume(issue)/page/year: 86,94,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED

其他信息

  • 用途一:镇咳药。
  • 方法一:对氨基苯甲酸乙酯先与溴丁烷在140-150℃缩合，再与聚乙二醇甲醚在105℃缩合得到退嗽。
  • 上游原料:溴丁烷 --> 苯唑卡因 --> 聚乙二醇单甲醚
  • MOL 文件:104-31-4.mol

系列性分类

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