四丁基铵硫氰酸盐
tetrabutylammomium thiocyanate
- 分子式：C17H36N2S
- 分子量：300.55
- CAS编号：3674-54-2
- 纯度：98%
基本信息
物性数据
| 项目 | 数据 | 测试条件 | 备注 | 数据来源 |
| 密度 g/mL | 1.2 | 20℃,101KPa | 液体, Pycnometric method | ILThermo |
| 熔点 ℃ | 125 | DSC/DTA | ILThermo |
参考谱图
安全信息
| Code |
Hazard Statement |
Source |
| H412 |
Harmful to aquatic life with long lasting effects |
Expert Curated |
| H401 |
Toxic to aquatic life |
Expert Curated |
| H332 |
Harmful if inhaled |
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 serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria |
| H318 |
Causes serious eye damage |
Expert Curated |
| H315 |
Causes skin irritation |
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 |
| H312 |
Harmful in contact with skin |
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 |
| H302+H312+H332 |
Harmful if swallowed, in contact with skin or if inhaled |
Expert Curated, Merck Life Science OY (Sigma-Aldrich) |
| 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 - most serious notifications, European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated |
| EUH032 |
Contact with acids liberates very toxic gas |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated |
| AUH032 |
Contact with acids liberates very toxic gas |
Expert Curated |
Other Names and Identifiers
Canonical SMILES
N#C[S-].CCCC[N+](CCCC)(CCCC)CCCC
InChI
InChI=1S/C16H36N.CHNS/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1-3/h5-16H2,1-4H3;3H/q+1;/p-1
InChI Key
RSHBFZCIFFBTEW-UHFFFAOYSA-M
7 Other Names for this Substance
- 1-Butanaminium, N,N,N-tributyl-, thiocyanate (9CI)
- Ammonium, tetrabutyl-, thiocyanate (8CI)
- Tetrabutylammonium thiocyanate (6CI, 7CI)
- Tetra-n-butylammonium thiocyanate
- Tetrabutylammonium isothiocyanate
- Tetrabutylammonium isothiocyanide
- Tetrabutylammonium rhodanide
参考文献
Experimental Properties
Thermal
Experimental Spectra
1H-NMR
- (1) Sigma-Aldrich Co. LLC. (Spectral Data were obtained from John Wiley & Sons, Inc.)
- (2) Copyright Bio-Rad Laboratories. All Rights Reserved.
- (3) "Integrated Spectral Data Base System of Organic Compounds" data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan)
13C-NMR
- (1) Sigma-Aldrich Co. LLC. (Spectral Data were obtained from John Wiley & Sons, Inc.)
- (2) Copyright Bio-Rad Laboratories. All Rights Reserved.
- (3) "Integrated Spectral Data Base System of Organic Compounds" data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan)
IR
- (1) Sigma-Aldrich Co. LLC. (Spectral Data were obtained from John Wiley & Sons, Inc.)
- (2) Copyright Bio-Rad Laboratories. All Rights Reserved.
- (3) "Integrated Spectral Data Base System of Organic Compounds" data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan)
- (4) Kobler, Heinz; Justus Liebigs Annalen der Chemie, (1978)(12), 1937, CAplus
Mass
(1) "Integrated Spectral Data Base System of Organic Compounds" data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan)
