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Tetrabutylammonium hydroxide 30-hydrate - 98%, high purity , CAS No.147741-30-8
Basic Description
Synonyms
TBAOH | 1-Butanaminium, N,N,N-tributyl-, hydroxide, hydrate (1:1:30) | AS-80340 | D87990 | DTXSID00584991 | Tetrabutylammonium hydroxide triacontahydrate | N,N,N-Tributylbutan-1-aminium hydroxide--water (1/1/30) | tetrabutylazanium;hydroxide;triacontahydr
Specifications & Purity
≥98%
Storage Temp
Store at 2-8°C,Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description
TBAH dissolved in HPLC grade diethyl ether has been used to compose the solvent system in a study.
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
IUPAC Name
tetrabutylazanium;hydroxide;triacontahydrate
INCHI
InChI=1S/C16H36N.31H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h5-16H2,1-4H3;31*1H2/q+1;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-1
InChIKey
DFGIRVKFXSRUOX-UHFFFAOYSA-M
Smiles
CCCC[N+](CCCC)(CCCC)CCCC.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[OH-]
Isomeric SMILES
CCCC[N+](CCCC)(CCCC)CCCC.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[OH-]
WGK Germany
3
Molecular Weight
799.93
Beilstein
3571228
Reaxy-Rn
19711344
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19711344&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Hygroscopic;Carbon dioxide sensitive
Refractive Index
1.498
Flash Point(°F)
100 °C
Flash Point(°C)
100°C
Melt Point(°C)
27-30 °C
Molecular Weight
799.900 g/mol
XLogP3
Hydrogen Bond Donor Count
31
Hydrogen Bond Acceptor Count
31
Rotatable Bond Count
12
Exact Mass
799.604 Da
Monoisotopic Mass
799.604 Da
Topological Polar Surface Area
31.000 Ų
Heavy Atom Count
48
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
32
Citations of This Product
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1 Citations
D23141795