1-丁基-3-甲基咪唑二腈胺盐
1-butyl-3-methylimidazolium dicyanamide
- 分子式：C10H15N5
- 分子量：205.26
- CAS编号：448245-52-1
- 纯度：98%
基本信息
| 产品名称： | 1-丁基-3-甲基咪唑二腈胺盐 | ||
| 英文名称： | 1-butyl-3-methylimidazolium dicyanamide | ||
| CAS编号： | 448245-52-1 | 简 写： | BMImN(CN)2 |
| 分 子 式 ： | C10H15N5 | 分 子 量 ： | 205.26 |
| 纯 度： | 98% | 产品编号： | CP0089 |
物性数据
| 项目 | 数据 | 测试条件 | 备注 | 数据来源 |
| 表面张力 mN/m | 48.6 | 25℃,101KPa | 液体, Ring tensiometer | ILThermo |
| 电导率 mS/cm | 11.7 | 25℃,101KPa | 液体, Alternating current cell with electrodes | ILThermo |
| 密度 g/mL | 1.061 | 25℃ | H2O<500ppm | 2017客户文章 |
| 密度 g/mL | 1.0602 | 25℃,101KPa | 液体, Vibrating tube method | ILThermo |
| 热分解温度 ℃ | 286.8 | 实验实测 | ||
| 热分解温度 ℃ | 283 | H2O<500ppm | 2017客户文章 | |
| 熔点 ℃ | -6 | DSC/DTA | ILThermo | |
| 熔点 ℃ | -6 | H2O<500ppm | 2017客户文章 | |
| 熔点 ℃ | -15 | H2O,1.2% | 2011论文 | |
| 粘度 cP | 31 | 25℃ | H2O,1.2% | 2011论文 |
| 粘度 cP | 30.1 | 25℃,101KPa | 液体, Concentric cylinders viscometry | ILThermo |
| 粘度 cP | 29.3 | 25℃ | H2O<500ppm | 2017客户文章 |
| 粘度 cP | 11 | 80℃ | H2O,1.2% | 2011论文 |
| 粘度 cP | 6 | 100℃ | H2O,1.2% | 2011论文 |
| 粘度 cP | 4 | 120℃ | H2O,1.2% | 2011论文 |
| 折光率 | 1.508 | 25℃,101KPa | 液体, Standard Abbe refractometry | ILThermo |
参考谱图
1-丁基-3-甲基咪唑二腈胺盐,BMImN(CN)2,448245-52-1,1-butyl-3-methylimidazolium dicyanamide,核磁 NMR, H谱, 氘代丙酮
1-丁基-3-甲基咪唑二腈胺盐,BMImN(CN)2,448245-52-1,1-butyl-3-methylimidazolium dicyanamide,核磁 NMR, C谱, 氘代丙酮
1-丁基-3-甲基咪唑二腈胺盐,BMImN(CN)2,448245-52-1,1-butyl-3-methylimidazolium dicyanamide,核磁 NMR, H谱, 氘代DMSO
Srour, Hassan; Green Chemistry, (2013), 15(5), 1341-1347, CAplus
1-丁基-3-甲基咪唑二腈胺盐,BMImN(CN)2,448245-52-1,1-butyl-3-methylimidazolium dicyanamide,核磁 NMR, C谱, 氘代DMSO
Srour, Hassan; Green Chemistry, (2013), 15(5), 1341-1347, CAplus
1-丁基-3-甲基咪唑二腈胺盐,BMImN(CN)2,448245-52-1,1-butyl-3-methylimidazolium dicyanamide,ESI-MS
Srour, Hassan; Green Chemistry, (2013), 15(5), 1341-1347, CAplus
安全信息
| Code |
Hazard Statement |
Source |
| H411 |
Toxic to aquatic life with long lasting effects |
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 |
| H373 |
May cause damage to organs; through prolonged or repeated exposure |
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 |
| 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, Merck Life Science OY (Sigma-Aldrich) |
| 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 according to CLP criteria, Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
| H318 |
Causes serious eye damage |
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 |
| 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 according to CLP criteria, Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
| H314 |
Causes severe skin burns and eye damage |
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 |
| H311 |
Toxic in contact with skin |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria |
| H302 |
Harmful if swallowed |
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 according to CLP criteria, Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
| H301 |
Toxic if swallowed |
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 |
Other Names and Identifiers
Canonical SMILES
N#C[N-]C#N.C1=C[N+](=CN1C)CCCC
InChI
InChI=1S/C8H15N2.C2N3/c1-3-4-5-10-7-6-9(2)8-10;3-1-5-2-4/h6-8H,3-5H2,1-2H3;/q+1;-1
InChI Key
ICIVTHOGIQHZRY-UHFFFAOYSA-N
7 Other Names for this Substance
- 1H-Imidazolium, 1-butyl-3-methyl-, salt with cyanocyanamide (1:1) (9CI)
- 1-Butyl-3-methylimidazolium dicyanamide
- 1-Butyl-3-methylimidazolium dicyanoamide
- 1-Butyl-3-methylimidiazolium dicyanamide
- 1-n-Butyl-3-methylimidazolium dicyanoamide
- 3-Butyl-1-methylimidazolium dicyanoimide
- Butylmethylimidazolium dicyanamide
参考文献
Experimental Properties
Biological
Chemical
Density
- (1) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (2) Asumana, Charles; Green Chemistry, (2010), 12(11), 2030-2037, CAplus
- (3) Bogdanov, Milen G.; Zeitschrift fuer Naturforschung, B: A Journal of Chemical Sciences, (2009), 64(2), 215-222, CAplus
- (4) McHale, Glen; Analytical Chemistry (Washington, DC, United States), (2008), 80(15), 5806-5811, CAplus
- (5) Nieto de Castro, Carlos A.; Fluid Phase Equilibria, (2010), 294(1-2), 157-179, CAplus
- (6) Paduszynski, Kamil; Journal of Physical Chemistry B, (2013), 117(23), 7034-7046, CAplus
- (7) Palomar, J.; Separation and Purification Technology, (2019), 213, 578-586, CAplus
- (8) Slattery, John M.; Angewandte Chemie, International Edition, (2007), 46(28), 5384-5388, CAplus
- (9) Stoppa, Alexander; Journal of Chemical & Engineering Data, (2009), 54(2), 472-479, CAplus
- (10) Galan Sanchez, Lara; Journal of Chemical & Engineering Data, (2009), 54(10), 2803-2812, CAplus
- (11) Zech, Oliver; Journal of Chemical & Engineering Data, (2010), 55(5), 1774-1778, CAplus
Electrical
- (1) Zech, Oliver; Journal of Chemical & Engineering Data, (2010), 55(5), 1774-1778, CAplus
- (2) Stoppa, Alexander; Journal of Chemical & Engineering Data, (2009), 54(2), 472-479, CAplus
- (3) Stoppa, Alexander; Journal of Physical Chemistry B, (2008), 112(16), 4854-4858, CAplus
- (4) Leys, Jan; Journal of Chemical Physics, (2010), 133(3), 034503/1-034503/10, CAplus
- (5) Slattery, John M.; Angewandte Chemie, International Edition, (2007), 46(28), 5384-5388, CAplus
Flow and Diffusion
- (1) Nieto de Castro, Carlos A.; Fluid Phase Equilibria, (2010), 294(1-2), 157-179, CAplus
- (2) Santiago, R.; Separation and Purification Technology, (2018), 204, 38-48, CAplus
- (3) Palomar, J.; Separation and Purification Technology, (2019), 213, 578-586, CAplus
- (4) Vanecht, Evert; Physical Chemistry Chemical Physics, (2011), 13(30), 13565-13571, CAplus
- (5) Paduszynski, Kamil; Journal of Physical Chemistry B, (2013), 117(23), 7034-7046, CAplus
- (6) Santiago, R.; Separation and Purification Technology, (2018), 204, 38-48, CAplus
- (7) Palomar, J.; Separation and Purification Technology, (2019), 213, 578-586, CAplus
- (8) Slattery, John M.; Angewandte Chemie, International Edition, (2007), 46(28), 5384-5388, CAplus
- (9) McHale, Glen; Analytical Chemistry (Washington, DC, United States), (2008), 80(15), 5806-5811, CAplus
- (10) Galan Sanchez, Lara; Journal of Chemical & Engineering Data, (2009), 54(10), 2803-2812, CAplus
- (11) Asumana, Charles; Green Chemistry, (2010), 12(11), 2030-2037, CAplus
- (12) Fendt, Sebastian; Journal of Chemical & Engineering Data, (2011), 56(1), 31-34, CAplus
Interface
Structure Related
Thermal
- (1) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (2) Zech, Oliver; Journal of Chemical & Engineering Data, (2010), 55(5), 1774-1778, CAplus
- (3) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (4) Chambreau, Steven D.; Journal of Physical Chemistry B, (2010), 114(3), 1361-1367, CAplus
- (5) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (6) Paulechka, Yauheni U.; Journal of Chemical & Engineering Data, (2010), 55(8), 2719-2724, CAplus
- (7) Leys, Jan; Journal of Chemical Physics, (2010), 133(3), 034503/1-034503/10, CAplus
- (8) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (9) Nieto de Castro, Carlos A.; Fluid Phase Equilibria, (2010), 294(1-2), 157-179, CAplus
- (10) Calvar, Noelia; Thermochimica Acta, (2013), 565, 178-182, CAplus
- (11) Paulechka, Yauheni U.; Journal of Chemical & Engineering Data, (2010), 55(8), 2719-2724, CAplus
- (12) Fredlake, Christopher P.; Journal of Chemical and Engineering Data, (2004), 49(4), 954-964, CAplus
- (13) L. Perez, Jesus Paulo; Journal of Physical Chemistry C, (2013), 117(11), 5693-5707, CAplus
- (14) McCrary, Parker D.; Energy & Fuels, (2014), 28(5), 3460-3473, CAplus
- (15) Kroon, Maaike C.; Thermochimica Acta, (2007), 465(1-2), 40-47, CAplus
- (16) Zech, Oliver; Journal of Chemical & Engineering Data, (2010), 55(5), 1774-1778, CAplus
- (17) Asumana, Charles; Green Chemistry, (2010), 12(11), 2030-2037, CAplus
- (18) Nieto de Castro, Carlos A.; Fluid Phase Equilibria, (2010), 294(1-2), 157-179, CAplus
Experimental Spectra
1H-NMR
- (1) Kitaoka, Satoshi; Chemistry Letters, (2016), 45(4), 385-387, CAplus
- (2) Zhang, Shiguo; New Journal of Chemistry, (2012), 36(4), 1043-1050, CAplus
- (3) Ab Rani, M. A.; Physical Chemistry Chemical Physics, (2011), 13(37), 16831-16840, CAplus
- (4) Srour, Hassan; Green Chemistry, (2013), 15(5), 1341-1347, CAplus
- (5) Yoshida, Yukihiro; Journal of Physical Chemistry B, (2007), 111(18), 4742-4749, CAplus
- (6) McCrary, Parker D.; Chemical Communications (Cambridge, United Kingdom), (2012), 48(36), 4311-4313, CAplus
- (7) De Los Rios, Antonia P.; Biocatalysis and Biotransformation, (2007), 25(2-4), 151-156, CAplus
- (8) Pitula, Slawomir; Physical Chemistry Chemical Physics, (2010), 12(26), 7056-7063, CAplus
- (9) Tanner, Eden E. L.; Organic & Biomolecular Chemistry, (2013), 11(43), 7516-7521, CAplus
- (10) Zheng, Yong; Science China: Chemistry, (2012), 55(8), 1587-1597, CAplus
- (11) Jork, C.; Journal of Chemical Thermodynamics, (2005), 37(6), 537-558, CAplus
- (12) Yoshida, Yukihiro; Journal of Physical Chemistry B, (2007), 111(18), 4742-4749, CAplus
- (13) Richter, Kai; Angewandte Chemie, International Edition, (2010), 49(13), 2431-2435, S2431/1-S2431/9, CAplus
- (14) Vendilo, A. G.; Journal of Inclusion Phenomena and Macrocyclic Chemistry, (2010), 66(3-4), 223-230, CAplus
- (15) Qiu, Bo; Journal of Materials Chemistry A: Materials for Energy and Sustainability, (2013), 1(21), 6373-6378, CAplus
- (16) McCrary, Parker D.; Energy & Fuels, (2014), 28(5), 3460-3473, CAplus
- (17) Kaerkkaeinen, Johanna; Zeitschrift fuer Naturforschung, B: Chemical Sciences, (2004), 59(7), 763-770, CAplus
- (18) Liu, Qingbin; Green Chemistry, (2005), 7(1), 39-42, CAplus
- (19) Toral, Antonio Ruiz; Enzyme and Microbial Technology, (2007), 40(5), 1095-1099, CAplus
- (20) Zheng, Yong; Journal of Physical Chemistry A, (2010), 114(11), 3926-3931, CAplus
- (21) Brandt, Agnieszka; Green Chemistry, (2010), 12(4), 672-679, CAplus
- (22) Hernandez-Fernandez, F. J.; AIChE Journal, (2010), 56(5), 1213-1217, CAplus
- (23) Pitula, Slawomir; Physical Chemistry Chemical Physics, (2010), 12(26), 7056-7063, CAplus
- (24) Ab Rani, M. A.; Physical Chemistry Chemical Physics, (2011), 13(37), 16831-16840, CAplus
13C-NMR
- (1) Ab Rani, M. A.; Physical Chemistry Chemical Physics, (2011), 13(37), 16831-16840, CAplus
- (2) Srour, Hassan; Green Chemistry, (2013), 15(5), 1341-1347, CAplus
- (3) McCrary, Parker D.; Chemical Communications (Cambridge, United Kingdom), (2012), 48(36), 4311-4313, CAplus
- (4) Jork, C.; Journal of Chemical Thermodynamics, (2005), 37(6), 537-558, CAplus
- (5) McCrary, Parker D.; Energy & Fuels, (2014), 28(5), 3460-3473, CAplus
- (6) Zheng, Yong; Journal of Physical Chemistry A, (2010), 114(11), 3926-3931, CAplus
- (7) Brandt, Agnieszka; Green Chemistry, (2010), 12(4), 672-679, CAplus
Additional Spectra
IR
- (1) Penalber, Chariz Y.; Physical Chemistry Chemical Physics, (2012), 14(15), 5122-5131, CAplus
- (2) L. Perez, Jesus Paulo; Journal of Physical Chemistry C, (2013), 117(11), 5693-5707, CAplus
- (3) McCrary, Parker D.; Energy & Fuels, (2014), 28(5), 3460-3473, CAplus
- (4) Zheng, Yong; Journal of Physical Chemistry A, (2010), 114(11), 3926-3931, CAplus
- (5) Jork, C.; Journal of Chemical Thermodynamics, (2005), 37(6), 537-558, CAplus
- (6) Yoshida, Yukihiro; Journal of Physical Chemistry B, (2007), 111(18), 4742-4749, CAplus
Mass
- (1) Jork, C.; Journal of Chemical Thermodynamics, (2005), 37(6), 537-558, CAplus
- (2) Chambreau, Steven D.; Journal of Physical Chemistry B, (2010), 114(3), 1361-1367, CAplus
- (3) Kaerkkaeinen, Johanna; Zeitschrift fuer Naturforschung, B: Chemical Sciences, (2004), 59(7), 763-770, CAplus
- (4) Liu, Qingbin; Green Chemistry, (2005), 7(1), 39-42, CAplus
- (5) Brandt, Agnieszka; Green Chemistry, (2010), 12(4), 672-679, CAplus
- (6) Ab Rani, M. A.; Physical Chemistry Chemical Physics, (2011), 13(37), 16831-16840, CAplus
