2-Acetylbenzo[b]Thiophene 2-乙酰基苯并噻吩
CAS 22720-75-8 MFCD00090217
化学结构图
SMILES: CC(=O)c1cc2ccccc2s1
化学属性
| Mol. Formula | C10H8OS |
|---|---|
| Mol. Weight | 176 |
| Melting Point | 86-90 |
| TSCA | No |
| Density | 1.422 |
别名和识别编码
| Chemical Name | 2-Acetylbenzo[b]Thiophene |
|---|---|
| CAS Number | 22720-75-8 |
| Alfabeta Name | ACETYLBENZOTHIOPHENE 2- |
| MDL Number | MFCD00090217 |
| Synonym | 1-(Benzo[b]thiophen-2-yl)ethan-1-one 1-Benzo[b]thiophen-2-yl-ethanone 1-benzo[b]thien-2-ylethan-1-one 2-Acetylbenzo[b]thiophene 2-Acetylthianaphthene 2-乙酰基苯并[b]噻吩 Benzo[b]thien-2-yl Methyl Ketone |
| PubChem Substance ID | 87562949 |
| EC Number | 245-177-7 |
| Beilstein Registry Number | 118114 |
| Reaxys-RN | 118114 |
| Chemical Name Translation | 2-乙酰基苯并噻吩 |
| LabNetwork Molecule ID | LN00008027 |
| InChIKey | SGSGCQGCVKWRNM-UHFFFAOYSA-N |
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分类
- {uni_hamburg} no charge; sulfur heterocycle; carbocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; ketone; sulfide; 1fragment
- Sulfur & Selenium Compounds
- Pharmaceuticals
- Intermediates & Fine Chemicals
- {SNA} Benzothiophenes, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks
- Aromatics
产品应用
- 苯并噻吩化学的起始物质。
相关文献及参考
- Horiguchi, Y., et al.: Chem. Pharm. Bull., 52, 214 (2004),
- Joshi, E., et al.: Chem. Res. Toxicol., 17, 137 (2004),
- Short: III/35D3 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 3: Heterocycles Author: Gupta, R.R.; Jain, M.; Lechner, M.D.; Mikhova, B.M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D3 Year: 2007 Keyword: C-13; NMR; carbon-13; chemical shifts; coupling constants; heterocycles; nuclear magnetic resonance ISBN: 978-3-540-29731-4 ISBN: 3-540-29731-6 Internet Resource: DOI: 10.1007/978-3-540-47067-0 RefComment: VIII, 342 p., 1 illus., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. NMR is now a leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei B-11 and P-31, subvolume III/35B contains the nuclei F-19 and N-15, subvolume III/35C contains the nucleus H-1, subvolume III/35D contains the nucleus C-13, subvolume III/35E contains the nucleus O-17, and subvolume III/35G contains the nucleus Se-77. More nuclei are planned for future volumes.
- Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.199
安全信息
GHS Symbol
- H302 Harmful if swallowed 吞食有害
- H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
- R22 Harmful if swallowed 吞咽有害
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
- P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
- P273 Avoid release to the environment. 避免释放到环境中。
- P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
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