Bisacodyl, 98% 4,4’-(2-吡啶亚甲基)双酚二乙酸酯

CAS 603-50-9 MFCD00038039

化学结构图

603-50-9
SMILES: CC(=O)Oc1ccc(C(c2ccc(OC(C)=O)cc2)c2ccccn2)cc1

化学属性

Mol. FormulaC22H19NO4
Mol. Weight361
TSCAYes
Melting Point132.0 to 136.0 deg-C
SolubilityDMSO 72 mg/mL Water <1 mg/mL Ethanol <1 mg/mL

别名和识别编码

Chemical NameBisacodyl, 98%
CAS Number603-50-9
Synonym (4,4'-Diacetoxydiphenyl)(2-pyridyl)methane 2-(4,4'-Diacetoxydiphenylmethyl)pyridine 4,4'-(2-pyridylmethyl 4,4'-(2-pyridylmethylene)bisphenol diacetate 4,4'-(2-Pyridinylmethylene)bisphenol 4,4'-(2-pyridylmethylene)bisphenol diacetate 4,4'-(2-吡啶亚甲基)双酚二乙酸酯 4,4'-(2-吡啶甲 4,4'-DIACETOXYDIPHENYLPYRIDYL-2-METHANE 4,4'-Diacetoxydiphenylpyrid-2-ylmethane Agaroletten Apo Bisacodyl Apo-Bisacodyl Bekunis Bisacodyl Bicol Bis(p-acetoxyphenyl)-2-pyridylmethan Bisac Evac Bisac-Evac Bisacodyl Bisacodyl Tannex Bisacodyl Uniserts Bisacodyl, Bekunis Bisacodyl, Fleet Bisalax Bisco Lax Bisco Zitron Bisco-Lax Bisco-Zitron Broxalax
MDL NumberMFCD00038039
PubChem Substance ID354334116
EC Number210-044-4
Merck Number1242
Chemical Name Translation4,4’-(2-吡啶亚甲基)双酚二乙酸酯
Wiswesser Line NotationT6NJ BYR DOV1&R DOV1
Beilstein Registry Number0323727
LabNetwork Molecule IDLN01277896
Reaxys-RN323727
InChIInChI=1S/C22H19NO4/c1-15(24)26-19-10-6-17(7-11-19)22(21-5-3-4-14-23-21)18-8-12-20(13-9-18)27-16(2)25/h3-14,22H,1-2H3
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分类

  • {SNA} Analytical Standards, Chromatography, EP Standards, EP Standards A - B, Pharmaceutical Standards, Pharmacopeia Standards, 分析/色谱
  • {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, B, BI - BZ, Bioactive Small Molecules, Chromatography, Drugs & Metabolites, Forensic and Veterinary Standards, Neat Compounds, 细胞生物学
  • {SNA} Analytical Standards, Analytical/Chromatography, Chromatography, EP Standards, EP Standards A - B, Pharmaceutical Standards, Pharmacopeia Standards
  • Pharmaceuticals
  • {uni_hamburg} no charge; nitr

产品应用

  • Cathartic.

相关文献及参考

  • Schmidt, et al.: Arzneim.-Forsch., 3, 19 (1953),
  • Wald, A., et al.: J. Clin. Gastroenterol., 36, 386 (2003),
  • Short: IV/8A Title: Enthalpies of Fusion and Transition of Organic Compounds Author: Zhang, Z.-Y.; Frenkel, M.; March, K.N.; Wilhoit, R.C. Editor: Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8A Year: 1995 Keyword: organic compounds; enthaly of fusion; melting point; phase transition ISBN: 3-540-58854-X ISBN: 978-3-540-58854-2 Internet Resource: DOI:10.1007/b55145 RefComment: VIII, 588 pages.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

RTECSSM8750000
GHS Symbol
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H303 May be harmfully swallowed 吞食可能有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
WGK Germany3
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
Storage condition 储存温度-20°C 2-8°C 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : In

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Mammal - dog
DOSE/DURATION           : >15 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: -,854,1990

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 40 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: 3,19,1953

TYPE OF TEST            : LD50 - L

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 17500 mg/kg
TOXIC EFFECTS :
   Behavioral - ataxia
   Lungs, Thorax, or Respiration - respiratory stimulation
   Blood - hemorrhage
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   2,243,1960

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - dog
DOSE/DURATION           : 40 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: 3,19,1953

其他信息

  • Sigma Aldrich:603-50-9(sigmaaldrich)
  • 上游原料:苯酚 --> 2-甲基吡啶
  • MOL 文件:603-50-9.mol
  • 比沙可啶
  • 用途一:是安全有效的缓泻药物，用于治疗便秘
  • MSDS 信息:[4-[(4-Acetyloxyphenyl)-pyridin-2-ylmethyl]phenyl] acetate(603-50-9).msds

系列性分类

  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Bioactive Small Molecules - Cell Biology
  4. B - Bioactive Small Molecules
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. B - Alphabetic
  5. BI - BZ - B

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