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Merck
CN

86908

Tetrabutylammonium thiophenolate

≥97.0% (NT), technical grade, crystals

Synonym(s):

Thiophenol tetrabutylammonium salt

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About This Item

Linear Formula:
(CH3CH2CH2CH2)4N(C6H5S)
CAS Number:
4670-62-6
Molecular Weight:
351.63
NACRES:
NA.22
PubChem Substance ID:
57653214
UNSPSC Code:
12352116
MDL number:
MFCD00270142
Beilstein/REAXYS Number:
4283352

Key Documents

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Product Name

Tetrabutylammonium thiophenolate, technical, ≥97.0% (NT)

InChI

1S/C16H36N.C6H6S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;7-6-4-2-1-3-5-6/h5-16H2,1-4H3;1-5,7H/q+1;/p-1

SMILES string

[S-]c1ccccc1.CCCC[N+](CCCC)(CCCC)CCCC

InChI key

DCYKVBXIMAFNDD-UHFFFAOYSA-M

grade

technical

assay

≥97.0% (NT)

form

crystals

mp

77-85 °C, 82-85 °C (lit.)

storage temp.

2-8°C

Other Notes

Thiophenolate soluble in organic solvents

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
061952/1
61952/1

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M. Novi et al.
The Journal of Organic Chemistry, 52, 5382-5382 (1987)
Displacement reactions of a 1,2-anhydro-alpha-D-hexopyranose: installation of useful functionality at the anomeric carbon.
D M Gordon et al.
Carbohydrate research, 206(2), 361-366 (1990-10-10)

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