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Hexadecyltrimethylammonium hydroxide solution - 10 wt. % in H2O, high purity , CAS No.505-86-2
Basic Description
Synonyms
8Q7D6895LV | Cetyltrimethylammonium Hydroxide | cetyl-trimethylammonium hydroxide | EINECS 208-022-4 | H0974 | SCHEMBL112145 | D91029 | hexadecyl(trimethyl)azanium;hydroxide | trimethylhexadecylammonium hydroxide | AKOS027382836 | 1-Hexadecanaminium, N,N,
Specifications & Purity
10 wt. % in H2O
Storage Temp
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
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 salts Organic oxoanionic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic acyclic compounds
Substituents
Tetraalkylammonium salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic hydroxide - 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
488184095
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488184095
IUPAC Name
hexadecyl(trimethyl)azanium;hydroxide
INCHI
InChI=1S/C19H42N.H2O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H2/q+1;/p-1
InChIKey
WJLUBOLDZCQZEV-UHFFFAOYSA-M
Smiles
CCCCCCCCCCCCCCCC[N+](C)(C)C.[OH-]
Isomeric SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)C.[OH-]
Molecular Weight
301.55
Reaxy-Rn
3723055
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3723055&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Heat sensitive
Refractive Index
n20/D 1.351
Flash Point(°C)
11 °C
Molecular Weight
301.600 g/mol
XLogP3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
15
Exact Mass
301.334 Da
Monoisotopic Mass
301.334 Da
Topological Polar Surface Area
1.000 Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
181.000
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.
Zhang Hanyuan, Xu Jianxiang, Zhang Xu, Wang Teng, Zhou Dairan, Shu Wei, Zhao Tingting, Fang Weijun.
(2022)
One-Pot Synthesis of Ag/Quaternary Ammonium Salt Co-Decorated Mesoporous Silica Nanoparticles for Synergistic Treatment of Cancer and Bacterial Infections. Frontiers in Bioengineering and Biotechnology,
10
2.
Siqin Jia, Qiguan Wang, Jian Chen, Sumin Wang.
(2021)
High-active nanoplates of nitrogen-doped carbon@Mo2C as efficient catalysts in water splitting. SYNTHETIC METALS,
279
(116847).
3.
Junyao Shen, Xinyi Gao, Wenze Guo, Jie Jiang, Jin-Jin Li, Ling Zhao, Zhenhao Xi, Weikang Yuan.
(2024)
Mechanism Study on Synthesis of Biobased Polycarbonate from Diphenyl Carbonate and Isosorbide with Metal-Free Catalysts by Identifying Reactivity of endo-OH and exo-OH. ACS Sustainable Chemistry & Engineering,
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3 Citations
F2520436