Tetrabutylammonium hydroxide solution（TBAOH） - 54.0-56.0% in H2O , CAS No.2052-49-5

CAS: 2052-49-5 Cat. No.: T432295 Formula: C₁₆H₃₇NO Molecular Weight: 259.47 Beilstein Registry Number: 3571228 EC Number: 218-147-6 PubChem CID: 2723671

GRADE & PURITY 54.0-56.0% in H2O

Synonyms

N,N,N-Tributyl-1-butanaminium hydroxide | Tetra-n-butylammonium hydroxide | TBAOH

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Overview

The product is 54.0-56.0% solution of tetrabutylammonium hydroxide in H 2 O. Tetrabutylammonium hydroxide has been synthesized from tetrabutylammonium iodide. TBAOH dissolved in anhydrous isopropyl alcohol is widely employed as titrant for weak acids.

Application

Tetrabutylammonium hydroxide solution (TBAOH) may be used in the following studies: For the dissolution of 10 wt% cellulose under room temperature conditions. As a catalyst during the synthesis of 1,2,4-oxadiazoles. Preparation of TBAOH salts of fatty acids.

Specifications

Synonyms

N,N,N-Tributyl-1-butanaminium hydroxide | Tetra-n-butylammonium hydroxide | TBAOH

Specifications & Purity

54.0-56.0% in H2O

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Names and Identifiers

Pubchem Sid

504760792

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504760792

Canonical Smiles

CCCC[N+](CCCC)(CCCC)CCCC.[OH-]

IUPAC Name

tetrabutylazanium;hydroxide

InChIKey

VDZOOKBUILJEDG-UHFFFAOYSA-M

INCHI

1S/C16H36N.H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H2/q+1;/p-1

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.[OH-]

WGK Germany

3

PubChem CID

2723671

UN Number

3267

Packing Group

II

Molecular Weight

259.47

Beilstein

3571228

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: 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.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Staphylococcus epidermidis (22802 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Air sensitive
• Refractive Index: 1.400
• Molecular Weight: 259.470 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 259.288 Da
• Monoisotopic Mass: 259.288 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 18
• 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: 2

XLogP3

Frequently Asked Questions

How should this product be stored?

Store in a cool place under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2052-49-5, the molecular formula is C16H37NO, and the molecular weight is 259.47 g/mol. InChIKey VDZOOKBUILJEDG-UHFFFAOYSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.