1-苄基-3-甲基咪唑氯盐
1-Benzyl-3-methylimidazolium chloride
- 分子式:C11H13ClN2
- 分子量:208.69
- CAS编号:36443-80-8
- 纯度:99%
基本信息
产品名称: | 1-苄基-3-甲基咪唑氯盐 | ||
英文名称: | 1-benzyl-3-methylimidazolium chloride | ||
CAS编号: | 36443-80-8 | 简 写: | BzMImCl |
分 子 式 : | C11H13ClN2 | 分 子 量 : | 208.69 |
纯 度: | 99% | 产品编号: | CP0556 |
物性数据
项目 | 数据 | 测试条件 | 备注 | 数据来源 |
密度 g/mL | 1.1928 | 25℃,101KPa | 液体, Vibrating tube method | ILThermo |
热分解温度 ℃ | 180 | Alfa | ||
熔点 ℃ | 70 | ILThermo | ||
粘度 cP | 3725 | 25℃,101KPa | 液体, Capillary tube (Ostwald; Ubbelohde) method | ILThermo |
折光率 | 1.5365 | 25℃,101KPa | 液体, Standard Abbe refractometry | ILThermo |
参考谱图
1-苄基-3-甲基咪唑氯盐,BzMImCl,36443-80-8,1-benzyl-3-methylimidazolium chloride,核磁 NMR, H谱, 氘代DMSO
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 |
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 |
Other Names and Identifiers
Canonical SMILES
[Cl-].C=1C=CC(=CC1)C[N+]=2C=CN(C2)C
InChI
InChI=1S/C11H13N2.ClH/c1-12-7-8-13(10-12)9-11-5-3-2-4-6-11;/h2-8,10H,9H2,1H3;1H/q+1;/p-1
InChI Key
FCRZSGZCOGHOGF-UHFFFAOYSA-M
8 Other Names for this Substance
- 1H-Imidazolium, 1-methyl-3-(phenylmethyl)-, chloride (9CI)
- 1-Benzyl-3-methyl-1H-imidazol-3-ium chloride
- 1-Benzyl-3-methyl-1H-imidazolium chloride
- 1-Benzyl-3-methyl-3H-imidazolium chloride
- 1-Benzyl-3-methylimidazolium chloride
- 1-Methyl-3-benzylimidazolium chloride
- 3-Benzyl-1-methyl-1H-imidazol-3-ium chloride
- 3-Benzyl-1-methyl-1H-imidazolium chloride
参考文献
Experimental Properties
Chemical
Lipinski
Thermal
- (1) Erdmenger, Tina; Journal of Materials Chemistry, (2008), 18(43), 5267-5273, CAplus
- (2) Fayad, Elie J.; Angewandte Chemie, International Edition, (2010), 49(27), 4585-4588, S4585/1-S4585/9, CAplus
- (3) Sakizadeh, Kumars; US7163786, B1, 2007, CAplus
- (4) Zhuravlev, O. E.; Russian Journal of Applied Chemistry, (2011), 84(7), 1158-1164, CAplus
Experimental Spectra
1H-NMR
- (1) Rehm, Tobias; Dalton Transactions, (2016), 45(39), 15390-15398, CAplus
- (2) Eguillor, Beatriz; Organometallics, (2008), 27(3), 445-450, CAplus
- (3) Beillard, Audrey; Chemistry - A European Journal, (2015), 21(49), 17614-17617, CAplus
- (4) Kilpelaeinen, Ilkka; Journal of Agricultural and Food Chemistry, (2007), 55(22), 9142-9148, CAplus
- (5) Wang, Jinquan; Chemical Communications (Cambridge, United Kingdom), (2015), 51(60), 12076-12079, CAplus
- (6) Tang, Xiaodong; Advanced Synthesis & Catalysis, (2013), 355(10), 2019-2028, CAplus
- (7) Wang, Junhua; ChemSusChem, (2013), 6(11), 2079-2082, CAplus
- (8) Shirota, Hideaki; Journal of Physical Chemistry B, (2015), 119(29), 9173-9187, CAplus
- (9) Lima, Heather M.; Organic Letters, (2011), 13(21), 5736-5739, CAplus
- (10) Liu, Hui; Chemistry Letters, (2005), 34(8), 1184-1185, CAplus
- (11) Wang, Junhua; ChemSusChem, (2013), 6(11), 2079-2082, CAplus
- (12) Brenna, Stefano; Chemistry - A European Journal, (2006), 12(10), 2880-2888, CAplus
- (13) Eguillor, Beatriz; Organometallics, (2008), 27(3), 445-450, CAplus
- (14) Erdmenger, Tina; Journal of Materials Chemistry, (2008), 18(43), 5267-5273, CAplus
13C-NMR
- (1) Wolfgang Robien / University of Vienna (Spectral Data were obtained from John Wiley & Sons, Inc.)
- (2) Eguillor, Beatriz; Organometallics, (2008), 27(3), 445-450, CAplus
- (3) Beillard, Audrey; Chemistry - A European Journal, (2015), 21(49), 17614-17617, CAplus
- (4) Wang, Jinquan; Chemical Communications (Cambridge, United Kingdom), (2015), 51(60), 12076-12079, CAplus
- (5) Tang, Xiaodong; Advanced Synthesis & Catalysis, (2013), 355(10), 2019-2028, CAplus
- (6) Shirota, Hideaki; Journal of Physical Chemistry B, (2015), 119(29), 9173-9187, CAplus
- (7) Lima, Heather M.; Organic Letters, (2011), 13(21), 5736-5739, CAplus
- (8) Brenna, Stefano; Chemistry - A European Journal, (2006), 12(10), 2880-2888, CAplus