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Tetrabutylammonium fluoride trihydrate - technical, ≥90% (T), high purity , CAS No.87749-50-6

4 Citations

COA

Grade & Purity:

technical grade

≥90%(T)

Cas Number: 87749-50-6
Molecular Weight: 315.51
Beilstein Registry Number: 3761900
EC Number: 207-057-2
MDL number: MFCD00149981
PubChem CID: 11726816

In stock

Item Number

T476963

Grouped product items
SKU	Size	Availability	Price
T476963-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
T476963-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$17.90
T476963-50g	50g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$25.90
T476963-250g	250g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$89.90

Basic Description

Synonyms	DTXSID40185047 \| Q-201802 \| tetra-n-butyl ammonium fluoride trihydrate \| FT-0642069 \| tetrabutylammoniumfluorid trihydrate \| AM803598 \| MFCD00149981 \| A842360 \| tetra-n-butylammonium fluoride trihydrate \| AKOS015855444 \| BCP24498 \| tetrabutylazanium trihy
Specifications & Purity	technical grade, ≥90%(T)
Grade	technical grade
Product Description	Description Reactant for:Preparation of deprotecting agents in preparation of cellulose derivativesSynthesis of lipophilic peptides for DNA transfections in vivoDehydrobromination reactionsTetrabutylammonium fluoride trihydrate may be used in the following studies:Synthesis of novel 3-O-(2-methoxyethyl)cellulose.To compose the novel solvent dimethyl sulfoxide (DMSO) /tetrabutylammonium fluoride trihydrate, used for the acetylation of linters cellulose.Synthesis of neutral organometallic fluoro complex.Synthesis of fluoroaromatic compounds.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Quaternary ammonium salts

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	Organic salts Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework	Aliphatic acyclic compounds
Substituents	Tetraalkylammonium salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Amine - Organic cation - 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
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tetrabutylazanium;fluoride;trihydrate
INCHI	InChI=1S/C16H36N.FH.3H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;/h5-16H2,1-4H3;1H;3*1H2/q+1;;;;/p-1
InChIKey	VEPTXBCIDSFGBF-UHFFFAOYSA-M
Smiles	CCCC[N+](CCCC)(CCCC)CCCC.O.O.O.[F-]
Isomeric SMILES	CCCC[N+](CCCC)(CCCC)CCCC.O.O.O.[F-]
WGK Germany	3
PubChem CID	11726816
UN Number	1759
Molecular Weight	315.51
Beilstein	3761900

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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2 results found

Lot Number	Certificate Type	Date	Item
F2415095	Certificate of Analysis	Apr 10, 2024	T476963
F2415096	Certificate of Analysis	Apr 10, 2024	T476963

Chemical and Physical Properties

Melt Point(°C)	58-60°C
Molecular Weight	315.510 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	12
Exact Mass	315.315 Da
Monoisotopic Mass	315.315 Da
Topological Polar Surface Area	3.000 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	116.000
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	5

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