1-辛基-3-甲基咪唑氯盐
1-octyl-3-methylimidazolium chloride
- 分子式： C12H23ClN2
- 分子量：230.78
- CAS编号：64697-40-1
- 纯度：98%
基本信息
| 产品名称： | 1-辛基-3-甲基咪唑氯盐 | ||
| 英文名称： | 1-octyl-3-methylimidazolium chloride | ||
| CAS编号： | 64697-40-1 | 简 写： | OMImCl |
| 分 子 式 ： | C12H23ClN2 | 分 子 量 ： | 230.78 |
| 纯 度： | 98% | 产品编号： | CP0613 |
物性数据
| 项目 | 数据 | 测试条件 | 备注 | 数据来源 |
| long-term热稳定性 ℃ | 131.8 | 2014客户文章 | ||
| 表面张力 mN/m | 32.5 | 25℃,101KPa | 液体, Ring tensiometer | ILThermo |
| 纯度H2O ppm | 3400 | 2014客户文章 | ||
| 电导率 mS/cm | 0.02 | 30℃,101KPa | 液体, Alternating current cell with electrodes | ILThermo |
| 密度 g/mL | 1.0096 | 25℃,101KPa | 液体, Vibrating tube method | ILThermo |
| 密度 g/mL | 1.0062 | 30℃ | 80℃,2KPa,24h | 2017客户文章 |
| 密度 g/mL | 1.0005 | 40℃ | 80℃,2KPa,24h | 2017客户文章 |
| 密度 g/mL | 0.9948 | 50℃ | 80℃,2KPa,24h | 2017客户文章 |
| 密度 g/mL | 0.9892 | 60℃ | 80℃,2KPa,24h | 2017客户文章 |
| 密度 g/mL | 0.9836 | 70℃ | 80℃,2KPa,24h | 2017客户文章 |
| 密度 g/mL | 0.9781 | 80℃ | 80℃,2KPa,24h | 2017客户文章 |
| 热分解onset温度 ℃ | 276 | 2014客户文章 | ||
| 热分解peak温度 ℃ | 249 | 2014客户文章 | ||
| 热分解start温度 ℃ | 165 | 2014客户文章 | ||
| 熔点 ℃ | 12 | DSC/DTA | ILThermo | |
| 粘度 cP | 13300 | 25℃,101KPa | 液体, Concentric cylinders viscometry | ILThermo |
| 粘度 cP | 7340 | 30℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 4273 | 35℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 2767 | 40℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 1789 | 45℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 1198 | 50℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 828.3 | 55℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 588.7 | 60℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 426.3 | 65℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 375 | 80℃ | 2011论文 | |
| 粘度 cP | 316.7 | 70℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 237.1 | 75℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 181.4 | 80℃ | 80℃,2KPa,24h | 2017客户文章 |
| 粘度 cP | 161 | 100℃ | 2011论文 | |
| 粘度 cP | 81 | 120℃ | 2011论文 | |
| 折光率 | 1.5087 | 25℃,101KPa | 液体, Standard Abbe refractometry | ILThermo |
参考谱图
1-辛基-3-甲基咪唑氯盐,OMImCl,64697-40-1,1-octyl-3-methylimidazolium chloride,核磁 NMR, H谱, 氘代DMSO
1-辛基-3-甲基咪唑氯盐,OMImCl,64697-40-1,1-octyl-3-methylimidazolium chloride,核磁 NMR, H谱, 氘代丙酮
1-辛基-3-甲基咪唑氯盐,OMImCl,64697-40-1,1-octyl-3-methylimidazolium chloride,核磁 NMR, C谱, 氘代丙酮
安全信息
| Code |
Hazard Statement |
Source |
| H335 |
May cause respiratory irritation |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most common notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated |
| H319 |
Causes serious eye irritation |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most common notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
| H315 |
Causes skin irritation |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most common notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
Other Names and Identifiers
Canonical SMILES
[Cl-].C1=C[N+](=CN1C)CCCCCCCC
InChI
InChI=1S/C12H23N2.ClH/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;/h10-12H,3-9H2,1-2H3;1H/q+1;/p-1
InChI Key
OXFBEEDAZHXDHB-UHFFFAOYSA-M
6 Other Names for this Substance
- 1H-Imidazolium, 1-methyl-3-octyl-, chloride (9CI)
- 1-Methyl-3-n-octylimidazolium Chloride
- 1-Methyl-3-octyl-1H-imidazolium chloride
- 1-Methyl-3-octylimidazolium chloride
- 1-Octyl-3-methylimidazolium chloride
- 3-Methyl-1-octylimidazolium chloride
参考文献
Experimental Properties
Acoustic
Biological
Chemical
- (1) Jungnickel, Christian; Colloids and Surfaces, A: Physicochemical and Engineering Aspects, (2008), 316(1-3), 278-284, CAplus
- (2) Bai, Guangyue; Journal of Chemical Thermodynamics, (2008), 40(10), 1509-1516, CAplus
- (3) Saien, Javad; Colloids and Surfaces, A: Physicochemical and Engineering Aspects, (2013), 431, 34-41, CAplus
- (4) Preiss, Ulrich P.; Journal of Colloid and Interface Science, (2013), 412, 13-16, CAplus
- (5) Luczak, Justyna; Green Chemistry, (2010), 12(4), 593-601, CAplus
- (6) Cho, Chul-Woong; Journal of Physical Chemistry B, (2011), 115(19), 6040-6050, CAplus
Density
- (1) Singh, Tejwant; Journal of Solution Chemistry, (2009), 38(8), 1043-1053, CAplus
- (2) Kolbeck, C.; Journal of Physical Chemistry B, (2009), 113(25), 8682-8688, CAplus
- (3) Gomez, Elena; Journal of Chemical & Engineering Data, (2006), 51(2), 696-701, CAplus
- (4) Carrera, Goncalo V. S. M.; Tetrahedron, (2010), 66(45), 8785-8794, CAplus
- (5) Sun, Aijun; Chinese Journal of Chemistry, (2009), 27(9), 1741-1748, CAplus
- (6) Ning, Hui; Science China: Chemistry, (2012), 55(8), 1509-1518, CAplus
Electrical
Flow and Diffusion
Interface
Lipinski
Optical and Scattering
Structure Related
Thermal
- (1) Carrera, Goncalo V. S. M.; Tetrahedron, (2010), 66(45), 8785-8794, CAplus
- (2) Sun, Aijun; Chinese Journal of Chemistry, (2009), 27(9), 1741-1748, CAplus
- (3) Domanska, Urszula; Chemistry - A European Journal, (2003), 9(13), 3033-3041, CAplus
- (4) Pan, Q. W.; Asian Journal of Chemistry, (2010), 22(8), 6026-6030, CAplus
- (5) Bai, Guangyue; Journal of Chemical Thermodynamics, (2008), 40(10), 1509-1516, CAplus
- (6) Farooq, Amjad; Microporous and Mesoporous Materials, (2012), 158, 55-63, CAplus
- (7) Reinert, Laurence; Chemical Engineering Journal (Amsterdam, Netherlands), (2012), 209, 13-19, CAplus
- (8) Bai, Guangyue; Journal of Chemical Thermodynamics, (2008), 40(10), 1509-1516, CAplus
- (9) Farooq, Amjad; Microporous and Mesoporous Materials, (2012), 158, 55-63, CAplus
- (10) Reinert, Laurence; Chemical Engineering Journal (Amsterdam, Netherlands), (2012), 209, 13-19, CAplus
- (11) Bai, Guangyue; Journal of Chemical Thermodynamics, (2008), 40(10), 1509-1516, CAplus
- (12) Farooq, Amjad; Microporous and Mesoporous Materials, (2012), 158, 55-63, CAplus
- (13) Reinert, Laurence; Chemical Engineering Journal (Amsterdam, Netherlands), (2012), 209, 13-19, CAplus
- (14) Saien, Javad; Colloids and Surfaces, A: Physicochemical and Engineering Aspects, (2013), 431, 34-41, CAplus
- (15) Saien, Javad; Colloids and Surfaces, A: Physicochemical and Engineering Aspects, (2014), 444, 138-143, CAplus
- (16) Reinert, Laurence; Chemical Engineering Journal (Amsterdam, Netherlands), (2012), 209, 13-19, CAplus
- (17) Kroon, Maaike C.; Thermochimica Acta, (2007), 465(1-2), 40-47, CAplus
- (18) Sun, Aijun; Chinese Journal of Chemistry, (2009), 27(9), 1741-1748, CAplus
Experimental Spectra
1H-NMR
- (1) Rather, Mudasir Ahmad; Talanta, (2015), 131, 55-58, CAplus
- (2) Bhosale, Vikas K.; New Journal of Chemistry, (2017), 41(3), 1250-1258, CAplus
- (3) Goujon, Nicolas; Australian Journal of Chemistry, (2015), 68(3), 420-425, CAplus
- (4) Vieira, Rebecca C.; Journal of Physical Chemistry B, (2007), 111(18), 5023-5029, CAplus
- (5) Desset, Simon L.; Green Chemistry, (2009), 11(5), 630-637, CAplus
- (6) Yousefi, Maryam; Korean Journal of Chemical Engineering, (2017), 34(9), 2527-2535, CAplus
- (7) Men, Shuang; Chemical Physics Letters, (2017), 679, 207-211, CAplus
- (8) Satish, Lakkoji; Spectroscopy Letters, (2016), 49(6), 383-390, CAplus
- (9) Brica, S.; Chemical Science International Journal, (2017), 19(4), CSIJ.34482/1-CSIJ.34482/9, CAplus
- (10) Beyaz, Ayse; Colloids and Surfaces, B: Biointerfaces, (2004), 35(2), 119-124, CAplus
- (11) Liu, Hui; Chemistry Letters, (2005), 34(8), 1184-1185, CAplus
- (12) Gomez, Elena; Journal of Chemical & Engineering Data, (2006), 51(2), 696-701, CAplus
- (13) Goodchild, Ian; Journal of Colloid and Interface Science, (2007), 307(2), 455-468, CAplus
- (14) Singh, Tejwant; Journal of Physical Chemistry B, (2007), 111(27), 7843-7851, CAplus
- (15) Wang, Huiyong; Journal of Physical Chemistry B, (2008), 112(51), 16682-16689, CAplus
- (16) Alammar, Tarek; ChemSusChem, (2011), 4(12), 1796-1804, CAplus
- (17) Goujon, Nicolas; Australian Journal of Chemistry, (2015), 68(3), 420-425, CAplus
- (18) Ben Ghanem, Ouahid; Journal of Hazardous Materials, (2015), 297, 198-206, CAplus
- (19) Zhang, Dong L.; Industrial & Engineering Chemistry Research, (2008), 47(6), 1995-2001, CAplus
- (20) Desset, Simon L.; Green Chemistry, (2009), 11(5), 630-637, CAplus
- (21) Sun, Aijun; Chinese Journal of Chemistry, (2009), 27(9), 1741-1748, CAplus
- (22) Zhang, Qi Bo; Materials Chemistry and Physics, (2010), 119(1-2), 57-64, CAplus
- (23) Cremer, Till; Chemistry - A European Journal, (2010), 16(30), 9018-9033, S9018/1-S9018/7, CAplus
- (24) Pan, Q. W.; Asian Journal of Chemistry, (2010), 22(8), 6026-6030, CAplus
13C-NMR
- (1) Wolfgang Robien / University of Vienna (Spectral Data were obtained from John Wiley & Sons, Inc.)
- (2) Bhosale, Vikas K.; New Journal of Chemistry, (2017), 41(3), 1250-1258, CAplus
- (3) Vieira, Rebecca C.; Journal of Physical Chemistry B, (2007), 111(18), 5023-5029, CAplus
- (4) Zhang, Dong L.; Industrial & Engineering Chemistry Research, (2008), 47(6), 1995-2001, CAplus
- (5) Cremer, Till; Chemistry - A European Journal, (2010), 16(30), 9018-9033, S9018/1-S9018/7, CAplus
Additional Spectra
hetero NMR
IR
- (1) Spectral data were obtained from John Wiley & Sons, Inc.
- (2) Piao, Ling-Yu; Wuli Huaxue Xuebao, (2004), 20(9), 1083-1088, CAplus
- (3) Zhang, Qi Bo; Materials Chemistry and Physics, (2010), 119(1-2), 57-64, CAplus
- (4) Singh, Tejwant; Journal of Physical Chemistry B, (2007), 111(27), 7843-7851, CAplus
Mass
Raman
(1) Spectral data were obtained from John Wiley & Sons, Inc.
