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Diethyl(2-methoxyethyl)methylammonium Bis(fluorosulfonyl)imide - 98%, high purity , CAS No.1079129-48-8
Basic Description
Synonyms
D5238 | T70061 | N,N-Diethyl-N-methyl-N-(2-methoxyethyl)ammonium imidodisulfuryl fluoride | 1079129-48-8 | N,N-Diethyl-N-methyl-N-(2-methoxyethyl)ammoniumimidodisulfurylfluoride | N,N-Diethyl-2-methoxy-N-methylethanaminium Bis(fluorosulfonyl)amide | Dieth
Specifications & Purity
≥98%
Storage Temp
Argon charged
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Not available
Direct Parent
Cholines
Alternative Parents
Tetraalkylammonium salts Dialkyl ethers Organic salts Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Choline - Tetraalkylammonium salt - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Amine - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.
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
504772352
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504772352
IUPAC Name
bis(fluorosulfonyl)azanide;diethyl-(2-methoxyethyl)-methylazanium
INCHI
InChI=1S/C8H20NO.F2NO4S2/c1-5-9(3,6-2)7-8-10-4;1-8(4,5)3-9(2,6)7/h5-8H2,1-4H3;/q+1;-1
InChIKey
OHKPLVVWXQGNTL-UHFFFAOYSA-N
Smiles
CC[N+](C)(CC)CCOC.[N-](S(=O)(=O)F)S(=O)(=O)F
Isomeric SMILES
CC[N+](C)(CC)CCOC.[N-](S(=O)(=O)F)S(=O)(=O)F
Molecular Weight
326.37
Reaxy-Rn
19655124
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19655124&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Hygroscopic
Refractive Index
1.44
Melt Point(°C)
-22 °C
Molecular Weight
326.400 g/mol
XLogP3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
8
Rotatable Bond Count
7
Exact Mass
326.078 Da
Monoisotopic Mass
326.078 Da
Topological Polar Surface Area
95.300 Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
310.000
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
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1 Citations
C2425211