3-Methylbenzo[D]Thiazole-2(3H)-Thione 3-甲基苯并噻唑-2-硫酮
CAS 2254-94-6 MFCD00005817
化学结构图
SMILES: Cn1c(=S)sc2ccccc21
化学属性
| Mol. Formula | C8H7NS2 |
|---|---|
| Mol. Weight | 181.28 |
| Melting Point | 88-91 °C (lit.) |
别名和识别编码
| Chemical Name | 3-Methylbenzo[D]Thiazole-2(3H)-Thione |
|---|---|
| Synonym | 3-methylbenzothiazole-2(3H)-thione {uni_hamburg} 3-methyl-3H-benzothiazole-2-thione 3-甲基苯并噻唑-2-硫酮 1-methylbenzothiazole-2-thione 3-Methyl-3H-benzothiazole-2-thione 3-Methyl-1,3-benzothiazoline-2-thione 3-Methylbenzo[d]thiazoline-2-thione N-Methylbenzothiazole-2-thione N-Methylbenzthiazolthion N-Methylbenzothiazoline-2-thione 3-Methyl-2-benzothiazolinthion 2(3H)-Benzothiazolethione, 3-methyl- 3-Methylbenzothiazoline-2-thione 2-Benzothiazolinethione, 3-methyl- 3-Methylbenzothiazole-2-thione |
| MDL Number | MFCD00005817 |
| CAS Number | 2254-94-6 |
| PubChem Substance ID | 75264 |
| EC Number | 218-852-9 |
| Chemical Name Translation | 3-甲基苯并噻唑-2-硫酮 |
| InChIKey | IRNRNPNZAKHEAW-UHFFFAOYSA-N |
| InChI | InChI=1S/C8H7NS2/c1-9-6-4-2-3-5-7(6)11-8(9)10/h2-5H,1H3 |
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分类
- {SNA} Building Blocks, C8 to C9, Chemical Synthesis, Heterocyclic Building Blocks, Thiazoles
- {uni_hamburg} no charge; sulfur heterocycle; nitrogen heterocycle; carbocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; 1fragment
相关文献及参考
- 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
- Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CO-ROM's.
- 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.
安全信息
GHS Symbol
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P305+P351+P338
- 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
- S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
- 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；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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