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Tetrabutylammonium p-Toluenesulfonate

Catalog Number
ACM7182867
CAS Number
7182-86-7
Product Name
Tetrabutylammonium p-Toluenesulfonate
Structure
Category
Battery Materials
Synonyms
Tetrabutylammonium, salt with 4-methylbenzenesulphonic acid (1:1); tetrabutylammonium toluene-4-sulfonate; DTXSID80222102; EINECS 230-548-8; SCHEMBL157620; C23H43NO3S; tetrabutylammonium 4-methylbenzenesulfonate; C-36749; MFCD00043227; 7182-86-7;
Description
Tetrabutylammonium p-toluenesulfonate (TBAOTs) can be used as:
• A phase transfer catalyst (PTC) in SN2 fluorinations.
• An electrolyte in the preparation of conducting polymer polypyrrole (PPy) by electrochemical polymerization technique.
IUPAC Name
4-methylbenzenesulfonate;tetrabutylazanium;
Molecular Weight
413.66
Molecular Formula
C23H43NO3S
Canonical SMILES
CCCC[N+](CCCC)(CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-];
InChI
1S/C16H36N.C7H8O3S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-6-2-4-7(5-3-6)11(8,9)10/h5-16H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChI Key
REAVCZWUMGIGSW-UHFFFAOYSA-M
Melting Point
69 °C
Purity
>98.0%(T)
Solubility
soluble in Methanol
Appearance
White to Light yellow powder to crystal
Storage
Store under inert gas
Complexity
309
Covalently-Bonded Unit Count
2
EC Number
230-548-8
Exact Mass
413.296g/mol
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
28
MDL Number
MFCD00043227
Monoisotopic Mass
413.296g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Refractive Index
1.42
Rotatable Bond Count
12
Signal Word
Warning
Specific Gravity
1.41
Topological Polar Surface Area
65.6A^2
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