1,6,7-Trimethylnaphthalene 2,3,5-三甲基萘
CAS 2245-38-7 MFCD00044834
化学结构图
SMILES: Cc1cc2cccc(C)c2cc1C
化学属性
| Mol. Formula | C13H14 |
|---|---|
| Mol. Weight | 170.25 |
| Density | 1.007 g/mL at 25 °C(lit.) |
| Refractive index | n20/D 1.608(lit.) |
| Boiling Point | 285 °C at 762 mmHg |
| Flash Point | 24 °C |
| Melting Point | 25 °C |
别名和识别编码
| Chemical Name | 2,3,5-Trimethylnaphthalene |
|---|---|
| Synonym | 1,6,7-Trimethylnaphthalene {LY} 1,6,7-Trimethylnaphthalene {} {LY} 1,6,7-Trimethylnaphthalene {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnaphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,6,7-Trimethylnapht |
| MDL Number | MFCD00044834 |
| CAS Number | 2245-38-7 |
| EC Number | 218-833-5 |
| Reaxys-RN | 2040197 |
| PubChem Substance ID | 16732 |
| Chemical Name Translation | 2,3,5-三甲基萘 |
| LabNetwork Molecule ID | LN01307183 |
| InChI | InChI=1S/C13H14/c1-9-5-4-6-12-7-10(2)11(3)8-13(9)12/h4-8H,1-3H3 |
| Canonical SMILES | CC1=C2C=C(C)C(=CC2=CC=C1)C |
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分类
- {uni_hamburg} no charge; carbocycle; aromatic; large ring; fused rings; 6ring; 10ring; 1fragment
相关文献及参考
- Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., 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. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the 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 intend to 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 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.
- Short: IV/8F Title: Densities of Polycyclic Hydrocarbons Author: Wilhoit, R.C.; Hong, X.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R.; Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8F Year: 1999 Keyword: organic compounds; d
安全信息
- 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
- H302 Harmful if swallowed 吞食有害
- H400 Verytoxictoaquaticlife 对水生生物毒性非常大。
- H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
- 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。
- P273 Avoid release to the environment. 避免释放到环境中。
- P301+P312
- P301+P317
- P330 Rinse mouth. 漱口
- 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.....
其他信息
- 2,3,5-三甲基萘价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T0772 2,3,5-三甲基萘 2,3,5-Trimethylnaphthalene 100MG 821元
- Sigma Aldrich:2245-38-7(sigmaaldrich)
- MOL 文件:2245-38-7.mol
- 图谱信息:2,3,5-三甲基萘(2245-38-7)核磁图( 13 CNMR) 2,3,5-三甲基萘(2245-38-7)质谱(MS) 2,3,5-三甲基萘(2245-38-7)红外图谱(IR1)
- TCI Shanghai:2,3,5-三甲基萘 2,3,5-Trimethylnaphthalene,>;95.0%(GC)(2245-38-7)
