Tetrabutylammonium methanesulphonate supplier

Name
TETRABUTYLAMMONIUM METHANESULFONATE
EINECS 265-751-0
CAS No. 65411-49-6
Article Data2
CAS DataBase
Density
Solubility
Melting Point 78-80 °C
Formula C₁₇H₃₉NO₃S
Boiling Point
Molecular Weight 337.568
Flash Point
Transport Information
Appearance
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms methanesulfonate; tetrabutylazanium;
PSA 65.58000
LogP 5.24580

Tetrabutylammonium methanesulphonate Specification

The Tetrabutylammonium methanesulphonate, with the CAS registry number 65411-49-6, is also known as N,N,N-Tributylbutan-1-aminium methanesulfonate. Its EINECS number is 265-751-0. This chemical's molecular formula is C₁₇H₃₉NO₃S and molecular weight is 337.56. Its IUPAC name is called methanesulfonate; tetrabutylazanium. When you are using this chemical, please be cautious about it. You should not breathe its dust. Besides, you must avoid contacting it with skin and eyes. You can keep its container tightly closed and at temperature not exceeding 2-8 °C.

Physical properties of Tetrabutylammonium methanesulphonate: (1)ACD/LogP: -1.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.72; (4)ACD/LogD (pH 7.4): -1.72; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.78; (8)ACD/KOC (pH 7.4): 2.78; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 12.

Uses of Tetrabutylammonium methanesulphonate: it can be used to produce 2-methylsulfonyloxaethyl nitrate at temperature of 0 °C. This reaction will need reagent NO₂BF₄ and solvent CH₂Cl₂ with reaction time of 1 hour. The yield is about 89%.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCC[N+](CCCC)(CCCC)CCCC.CS(=O)(=O)[O-]
(2)InChI: InChI=1S/C16H36N.CH4O3S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-5(2,3)4/h5-16H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1
(3)InChIKey: XHYYGJAYKIYARQ-UHFFFAOYSA-M

Product Name

TETRABUTYLAMMONIUM METHANESULFONATE

Tetrabutylammonium methanesulphonate Specification

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