Thiopental Thiopental
CAS 76-75-5 MFCD00057564
化学结构图
SMILES: CCCC(C)C1(CC)C(=O)NC(=S)NC1=O
化学属性
| Mol. Formula | C11H18N2O2S |
|---|---|
| Mol. Weight | 242 |
| Melting Point | 158-160°C |
别名和识别编码
| Chemical Name | United States Pharmacopeia (USP) Reference Standard Thiopental |
|---|---|
| CAS Number | 76-75-5 |
| Synonym | {uni_hamburg} 5-Ethyl-5-(1-methylbutyl)-2-thiobarbituric acid Pentothal (+/-)-THIOPENTAL Penthiobarbital Pentothiobarbital Thiopentobarbital Intraval Thionembutal 5-Ethyldihydro-5-(1-methylbutyl)-2-thioxo-4,6(1H,5H)-pyrimidinedione 4,6,(1H,5H)-Pyrimidinedione, 5-ethyldihydro-5-(1-methylbutyl)-2-thioxo- Tiopentale thiopentobarbital thiopental Thiothal 5-Ethyl-5-(1-methylbutyl)-2-thiobarbituric acid Thiopentone pentothiobarbital Nesdonal Thiopental (±)-Thiopental 5-Ethyl-5-(1-methylbutyl)-2-thiobarbituric acid Pentothal Thiomebumal Pentothal 5-ethyl-5-(1-methylbutyl)-2-thiobarbituric acid |
| PubChem Substance ID | 3000715 |
| EC Number | 200-984-3 |
| MDL Number | MFCD00057564 |
| Chemical Name Translation | Thiopental |
| Wiswesser Line Notation | T6VMYMV FHJ CUS FY3&1 F2 |
| Beilstein Registry Number | 0209361 |
| InChI | InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16) |
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分类
- Abbott, Approved Therapeutics/Drug Candidates, Bioactive Small Molecules, Cell Biology, Cell Signaling and Neuroscience, Neurobiology, Neuroscience, Pharmacologicals, Sedative/Hypnotics, T
- {uni_hamburg} no charge; nitrogen heterocycle; alicycle; 6RingOnly; 6ring; amide; lactame; racemate; 1fragment
- {SNA} Abbott, Approved Therapeutics/Drug Candidates, Bioactive Small Molecules, Cell Biology, Cell Signaling and Neuroscience, Neurobiology, Neuroscience,
- {SNA} Analytical Standards, EP Standards, EP Standards S - T, Pharmacopeia Metrological Institutes Standards, 分析/色谱
- {SNA} Analytical Standards, Analytical/Chromatography, Chromatography,
产品应用
- A thio-derivative of Barbituric acid. Controlled substance (depressant). Anesthetic.
相关文献及参考
- Christensen, L., et al.: Toxicol. Appl. Pharmacol., 26, 495 (1973),
- McLeish, M. J., Anal. Profiles Drug Subs. Excip., 21, 535 (1992),
- 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
GHS Symbol
- H302 Harmful if swallowed 吞食有害
- P301+P310
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
- 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。
- S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
- R22 Harmful if swallowed 吞咽有害
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 120 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZIAQ "Drug Dosages in Laboratory Animals - A Handbook," Rev. ed., Barnes, C.D., and L.G. Eltherington, Berkeley, Univ. of California Press, 1973 Volume(issue)/page/year: -,260,1973
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Parenteral SPECIES OBSERVED : Amphibian - frog DOSE/DURATION : 74 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : PHTXA6 Pharmacology and Toxicology. English translation of FATOAO. (New York, NY) V.20-22, 1957-59. Discontinued. Volume(issue)/page/year: 20,569,1957
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 600 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 1,215,1946
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 110 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : FSTEAI Farmaco. Scienza e Tecnica. (Pavia, Italy) V.1-7, 1946-52. For publisher information, see FRPSAX. Volume(issue)
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent -
TYPE OF TEST : Cytogenetic analysis TEST SYSTEM : Human Leukocyte DOSE/DURATION : 1500 mg/L REFERENCE : TGANAK Tsitologiya i Genetika. Cytology and Genetics. For English translation, see CYGEDX. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1967- Volume(issue)/page/year: 18(1),13,1984
TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE : 1020 mg/kg SEX/DURATION : female 1-17 day(s) after conception TOXIC EFFECTS : Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) Reproductive - Effects on Embryo or Fetus - fetal death REFERENCE : REANBJ Revista Espanola de Anestesiologia y Reanimacion. (Barcellona, Spain) V.1-12, 1954-65. Volume(issue)/page/year: 26,137,1979
其他信息
- MOL 文件:76-75-5.mol
- Sigma Aldrich:76-75-5(sigmaaldrich)
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