Butalbital Butalbital

CAS 77-26-9 MFCD00056089

化学结构图

77-26-9
SMILES: C=CCC1(CC(C)C)C(=O)NC(=O)NC1=O

化学属性

Mol. FormulaC11H16N2O3
Mol. Weight224.29

别名和识别编码

Chemical Name(1.0 mg/mL in Methanol)
CAS Number77-26-9
Synonym ######## 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-methylpropyl)-5-(2-propenyl)- 5-Allyl-5-(2'-methyl-n-propyl) barbituric acid 5-Allyl-5-isobutyl-barbitursäure 5-Allyl-5-isobutylbarbituric acid Alisobumal Allylbarbital Allylbarbitone Allylbarbituric acid Allylisobutylbarbital Allylisobutylbarbiturate Butalbarbital Butalbital Iso-butylallylbarbituric acid Itobarbital Optalidon Profundal Sandoptal Tetrallobarbital allylbarbital butalbital butalbital, monosodium salt {} {} {uni_hamburg} 布他比妥
MDL NumberMFCD00056089
PubChem Substance ID2481
Beilstein Registry Number202119
EC Number201-017-8
Wiswesser Line NotationT6VMVMV FHJ F2U1 F1Y1&1
Chemical Name TranslationButalbital
InChIInChI=1S/C11H16N2O3/c1-4-5-11(6-7(2)3)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)
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分类

  • Amines
  • Heterocycles
  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • {uni_hamburg} no charge; nitrogen heterocycle; alicycle; 6RingOnly; 6ring; urea; amide; lactame; 1fragment
  • {SA} Alphabetic, Analytical Standards, Analytical/Chromatography, B, BI - BZ, Chromatography, Drugs & Metabolites, Forensic and Veterinary Standards, Neat Compounds
  • {SNA} Alphabetic, Analytical Standards, Analytical/Chromatography, B, BI - BZ

产品应用

  • Controlled substance (depressant). Sedative, hypnotic.

相关文献及参考

  • Inaba, T., et al.: Clin. Pharmacol. Ther., 18, 558 (1975),
  • Fritch, D., et al.: J. Anal. Toxicol., 33, 569 (2009),
  • Wille, S., et al.: Ther. Drug Monit., 31, 511 (2009),
  • Short: IV/1a Title: Densities of Liquid Systems: Nonaqueous Systems and Ternary Aqueous Systems Author: Lacmann, R.; Synowietz, C. Editor: Schäfer, Kl. Source: Landolt-Börnstein, New Series Volume: IV/1a Year: 1974 ISBN: 3-540-06269-6 ISBN: 978-3-540-06269-1 Internet Resource: DOI:10.1007/b20003 RefComment: X, 716 pages. Hardcover Abstract: Volume IV/1 contains information on the densities of liquid systems. It may be considered as a supplement to volume II/1 of the 6th Edition, which contains only a few data on nonaqueous systems. Data are not listed for all systems but primarily for those of greater interest where data for a larger range of concentrations were available.
  • 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

WGK Germany3
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。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • 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+P310
  • P301+P312
  • P302+P352
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P330 Rinse mouth. 漱口
  • P333+P313
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H302 Harmful if swallowed 吞食有害
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
RTECSCP8750000
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
Hazard Codes Xn
Risk Statements
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
  • R22 Harmful if swallowed 吞咽有害
Restrict {} 精神药品 精麻类化学品
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - woman
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Vascular - BP lowering not characterized in autonomic section
   Lungs, Thorax, or Respiration - respiratory depression
   Gastrointestinal - nausea or vomiting
REFERENCE :
   SAVEAB Sammlung von Vergiftungsfaellen.  (Berlin, Germany)  V.1-13, 1930-44;
   V.14, 1952-54.  For publisher information, see ARTODN.
   Volume(issue)/page/year: 10,181A,1939

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human - child
DOSE/DURATION           : 10 mg/kg
TOXIC EFFECTS :
   Behavioral - toxic psychosis
   Behavioral - coma
   Kidney, Ureter, Bladder - other changes
REFERENCE :
   SAVEAB Sammlung von Vergiftungsfaellen.  (Berlin, Germany)  V.1-13, 1930-44;
   V.14, 1952-54.  For publisher information, see ARTODN.
   Volume(issue)/page/ye

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - pigeon
DOSE/DURATION           : 75 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   21,315,1972

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 160 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und
   Pharmakologie.  (Berlin, Ger.) V.110-253, 1925-66.  For publisher
   information, see NSAPCC.  Volume(issue)/page/year: 152,341,1930

系列性分类


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