Neopentylbenzene 新戊基苯
CAS 1007-26-7 MFCD00038279
化学结构图
SMILES: CC(C)(C)Cc1ccccc1
化学属性
| Mol. Formula | C11H16 |
|---|---|
| Mol. Weight | 148.24 |
| Density | 0.859 |
| Refractive index | 1.4840 to 1.4880 |
| Boiling Point | 185-186 °C at 760 mmHg |
| Flash Point | 50°C(lit.) |
| TSCA | No |
| Melting Point | -44.72 °C |
别名和识别编码
| Chemical Name | Neopentylbenzene |
|---|---|
| Synonym | Neopentylbenzene {LY} Neopentylbenzene {} {LY} Neopentylbenzene {} {} {LY} Neopentylbenzene {} {} {} {LY} Neopentylbenzene {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Neopentylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} N |
| MDL Number | MFCD00038279 |
| CAS Number | 1007-26-7 |
| Beilstein Registry Number | 2037544 |
| PubChem Substance ID | 87575125 |
| Reaxys-RN | 2037544 |
| Chemical Name Translation | 新戊基苯 |
| LabNetwork Molecule ID | LN00199859 |
| InChI | InChI=1S/C11H16/c1-11(2,3)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3 |
| Canonical SMILES | CC(C)(C)CC1=CC=CC=C1 |
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分类
- {SNA} Arenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
- {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 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/8E Title: Densities of Aromatic 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/8E Year: 1998 Keyword: organic compounds; den
安全信息
GHS Symbol
- H226 Flammable liquid and vapour 易燃液体和蒸气
- R10 Flammable 易燃
- S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
- S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
- S43 In case of fire use ... (indicate in the space the precise type of fire-fighting equipment. If water increases the risk add -?Never use water) 着火时使用（指明具体的消防器材种类，如果用水增加危险，注明“禁止用水”
- P241+P242+P243
- 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。
- P303+P361+P353
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- 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。
- P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
- P370+P378
- P233 Keep container tightly closed. ?保持容器密闭。
- P403+P235
其他信息
- (2,2-二甲基丙基)苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P1013 新戊苯 Neopentylbenzene 5ML 320元 2010/06/21 306130100 (2,2-二甲基丙基)苯 (2,2-Dimethylpropyl)benzene 98% 10 ML 788元 2010/06/21 306130500 (2,2-二甲基丙基)苯 (2,2-Dimethylpropyl)benzene 98% 50 ML 3111元
- Sigma Aldrich:1007-26-7(sigmaaldrich)
- Alfa Aesar:新戊苯,97+% Neopentylbenzene, 97+%(1007-26-7)
- 图谱信息:(2,2-二甲基丙基)苯(1007-26-7)红外图谱(IR1) (2,2-二甲基丙基)苯(1007-26-7)核磁图( 1 HNMR) (2,2-二甲基丙基)苯(1007-26-7)核磁图( 13 CNMR) (2,2-二甲基丙基)苯(1007-26-7)质谱(MS)
- TCI Shanghai:新戊基苯 Neopentylbenzene,>;97.0%(GC)(1007-26-7)
- Acros Organics:(2,2-二甲基丙基)苯 (2,2-Dimethylpropyl)benzene, 98%(1007-26-7)
- MOL 文件:1007-26-7.mol
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