四丁基溴化鏻
Tetrabutylphosphonium bromide
- 分子式：C16H36BrP
- 分子量：339.33
- CAS编号：3115-68-2
- 纯度：99%
基本信息
物性数据
参考谱图
四丁基溴化鏻,P4444Br,3115-68-2,Tetrabutylphosphonium bromide,核磁 NMR, H谱, 氘代DMSO
安全信息
| Code |
Hazard Statement |
Source |
| H413 |
May cause long lasting harmful effects to aquatic life |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria |
| 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 |
| H401 |
Toxic to aquatic life |
Expert Curated |
| H361fd |
Suspected of damaging fertility. Suspected of damaging the unborn child |
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 |
| H361f |
Suspected of damaging fertility |
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 |
| H361d |
Suspected of damaging the unborn child |
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 |
| H361 |
Suspected of damaging fertility or the unborn child |
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 |
Acros Organics (Fisher Scientific), 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, Merck Life Science OY (Sigma-Aldrich) |
| H332 |
Harmful if inhaled |
Acros Organics (Fisher Scientific), European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated |
| H319 |
Causes serious eye irritation |
Acros Organics (Fisher Scientific), European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated, New Zealand Hazardous Substances and New Organisms (HSNO) Act - Classification of Chemicals |
| H318 |
Causes serious eye damage |
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) |
| H317 |
May cause an allergic skin reaction |
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 |
Acros Organics (Fisher Scientific), 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, Japan GHS Classifications (Japanese), Merck Life Science OY (Sigma-Aldrich), New Zealand Hazardous Substances and New Organisms (HSNO) Act - Classification of Chemicals |
| H314 |
Causes severe skin burns and eye damage |
Expert Curated |
| H312 |
Harmful in contact with skin |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria, Expert Curated, New Zealand Hazardous Substances and New Organisms (HSNO) Act - Classification of Chemicals |
| H311 |
Toxic in contact with skin |
Acros Organics (Fisher Scientific), 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) |
| H310 |
Fatal in contact with skin |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling according to CLP criteria |
| H302+H332 |
Harmful if swallowed or if inhaled |
Expert Curated |
| H302 |
Harmful if swallowed |
Acros Organics (Fisher Scientific), 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), New Zealand Hazardous Substances and New Organisms (HSNO) Act - Classification of Chemicals |
| H300 |
Fatal if swallowed |
European Chemical Agency (ECHA) Classification&Labelling Inventory - Notified classification and labelling - most serious notifications |
| H290 |
May be corrosive to metals |
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
[Br-].CCCC[P+](CCCC)(CCCC)CCCC
InChI
InChI=1S/C16H36P.BrH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1
InChI Key
RKHXQBLJXBGEKF-UHFFFAOYSA-M
10 Other Names for this Substance
- Phosphonium, tetrabutyl-, bromide (8CI, 9CI)
- Tetrabutylphosphonium bromide (6CI, 7CI)
- Cyphos 163
- Cyphos 443W
- Cyphos IL 163
- NSC 41942
- PX 4B
- T 1124
- TBP-BB
- Tetra-n-butylphosphonium bromide
参考文献
Experimental Properties
Biological
Nuclear
Thermal
| Property |
Value |
Condition |
Source |
|---|---|---|---|
| Melting Point |
107-108 °C |
|
|
| Melting Point |
100 °C |
|
|
| Melting Point |
99-101 °C |
|
|
Experimental Spectra
1H-NMR
- (1) Rauber, Daniel; Physical Chemistry Chemical Physics, (2017), 19(40), 27251-27258, CAplus
- (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) Bernard, Franciele L.; Energy & Fuels, (2017), 31(9), 9840-9849, CAplus
- (5) Dub, Pavel A.; Organometallics, (2009), 28(16), 4764-4777, CAplus
13C-NMR
- (1) Copyright Bio-Rad Laboratories. All Rights Reserved.
- (2) "Integrated Spectral Data Base System of Organic Compounds" data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan)
- (3) Dub, Pavel A.; Organometallics, (2009), 28(16), 4764-4777, CAplus
hetero NMR
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) Bernard, Franciele L.; Energy & Fuels, (2017), 31(9), 9840-9849, CAplus
- (5) Loris, Alessandro; Journal of Organic Chemistry, (2004), 69(11), 3953-3956, CAplus
- (6) Selva, Maurizio; Journal of Organic Chemistry, (2006), 71(15), 5770-5773, 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)
- (2) Hilger, Ryan T.; Analytical Chemistry (Washington, DC, United States), (2014), 86(17), 8822-8828, CAplus
Raman
(1) Sigma-Aldrich Co. LLC. (Spectral Data were obtained from John Wiley & Sons, Inc.)
