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Tetrapentylammonium bromide - for ion pair chromatography, ≥99.0%, high purity , CAS No.866-97-7
Basic Description
Synonyms
MFCD00011856 | EINECS 212-756-0 | T1432 | 1-Pentanaminium, N,N,N-tripentyl-, bromide | D95390 | DTXSID40883596 | Tetraamylammonium bromide | TetraamylammoniumBromide | tetrapentyl ammonium bromide | HY-W011052 | 1-Pentanaminium, N,N,N-tripentyl-, bromide
Specifications & Purity
for ion pair chromatography, ≥99%
Shipped In
Normal
Grade
for ion pair chromatography
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Not available
Direct Parent
Tetraalkylammonium salts
Alternative Parents
Organopnictogen compounds Organic bromide salts Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic acyclic compounds
Substituents
Tetraalkylammonium salt - Organopnictogen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Amine - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
488184465
IUPAC Name
tetrapentylazanium;bromide
INCHI
InChI=1S/C20H44N.BrH/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;/h5-20H2,1-4H3;1H/q+1;/p-1
InChIKey
SPALIFXDWQTXKS-UHFFFAOYSA-M
Smiles
CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Br-]
Isomeric SMILES
CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Br-]
WGK Germany
3
PubChem CID
70086
Molecular Weight
378.47
Beilstein
3658171
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in water.
Sensitivity
Moisture sensitive
Melt Point(°C)
101 °C
Molecular Weight
378.500 g/mol
XLogP3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
16
Exact Mass
377.266 Da
Monoisotopic Mass
377.266 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
22
Formal Charge
0
Complexity
155.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
2
Citations of This Product
1.
Zhong Yuan, Zhang Jiangwei, Li Tingting, Xu Wenwu, Yao Qiaofeng, Lu Min, Bai Xue, Wu Zhennan, Xie Jianping, Zhang Yu.
(2023)
Suppression of kernel vibrations by layer-by-layer ligand engineering boosts photoluminescence efficiency of gold nanoclusters.
Nature Communications,
14
(1):
(1-12).
2.
Jiancheng Lan, Hammad Saulat, Haowen Wu, Liangqing Li, Jianhua Yang, Jinming Lu, Yan Zhang.
(2020)
Manipulation on microstructure of MFI membranes by binary structure directing agents.
MICROPOROUS AND MESOPOROUS MATERIALS,
299
(110128).
3.
Binwang Yang, Zhixiong Ye, Feiyu Lu, Jianna Yu, Jiaxu Liu, Xiuqing Zheng, Cheng Wang, Lian Duan, Zhijian Yang, Guoxing Jing, Wen Liu, Wenshan Li, Wenjie Liu.
(2024)
High Resolving Power Electrospray Ionization Ion Mobility Spectrometer Based on Fourier Deconvolution Multiplexing.
ANALYTICAL CHEMISTRY,
96
(43):
(17423-17431).
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