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Tetrabutylammonium 4-toluenesulfonate

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Name

Tetrabutylammonium 4-toluenesulfonate

EINECS 230-548-8
CAS No. 7182-86-7 Density N/A
PSA 65.58000 LogP 6.98350
Solubility N/A Melting Point 70-72 °C(lit.)
Formula C16H36N.C7H7O3S Boiling Point N/A
Molecular Weight 413.665 Flash Point N/A
Transport Information N/A Appearance N/A
Safety S26;S36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 7182-86-7 (Tetrabutylammonium 4-toluenesulfonate) Hazard Symbols
Synonyms

Tetrabutylammonium, salt with 4-methylbenzenesulphonic acid (1:1);

Article Data 8

Tetrabutylammonium 4-toluenesulfonate Specification

The Tetrabutylammonium 4-toluenesulfonate with its cas register number is 7182-86-7. It also can be called as and the IUPAC Name about this chemical is 4-methylbenzenesulfonate; tetrabutylazanium.

Physical properties about Tetrabutylammonium 4-toluenesulfonate are: (1)H-Bond Acceptor: 3; (2)Rotatable Bond Count: 12; (3)Exact Mass: 413.296365; (4)MonoIsotopic Mass: 413.296365; (5)Topological Polar Surface Area: 65.6; (6)Heavy Atom Count: 28; (7)Complexity: 309; (8)Covalently-Bonded Unit Count: 2.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCC[N+](CCCC)(CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]
(2)InChI: 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
(3)InChIKey: REAVCZWUMGIGSW-UHFFFAOYSA-M

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