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Merck
CN

345490

Zinc p-toluenesulfonate hydrate

Synonym(s):

p-Toluenesulfonic acid zinc salt

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About This Item

Linear Formula:
(CH3C6H4SO3)2Zn·xH2O
CAS Number:
13438-45-4
Molecular Weight:
407.78 (anhydrous basis)
UNSPSC Code:
12352302
NACRES:
NA.23
PubChem Substance ID:
24861327
EC Number:
236-576-7
Beilstein/REAXYS Number:
4339837
MDL number:
MFCD00151013
Assay:
≥98.5% (HPLC)
Form:
powder

Key Documents

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InChI key

JCOXFVWERPVZPB-UHFFFAOYSA-L

InChI

1S/2C7H8O3S.H2O.Zn/c2*1-6-2-4-7(5-3-6)11(8,9)10;;/h2*2-5H,1H3,(H,8,9,10);1H2;/q;;;+2/p-2

SMILES string

O.[Zn++].Cc1ccc(cc1)S([O-])(=O)=O.Cc2ccc(cc2)S([O-])(=O)=O

assay

≥98.5% (HPLC)

form

powder

reaction suitability

reagent type: catalyst
core: zinc

concentration

≤15.7% Zn (EDTA titration)

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

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

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Certificates of Analysis (COA)

Lot/Batch Number
75196KJ
10602ME
15802EA
13916PU
07614LI

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Chika Taniguchi et al.
International journal of pharmaceutics, 434(1-2), 148-154 (2012-05-31)
This study was undertaken to develop new dipyridamole (DP) formulations with acidic microenvironmental pH-modifiers for improving dissolution and absorption under hypochlorhydric conditions. Dipyridamole granules (DPG) with ten acidic pH-modifiers were prepared with conventional wet granulation, and their manufacturability, stability and
Iliyan Ivanov et al.
Molecules (Basel, Switzerland), 16(8), 7019-7042 (2011-08-19)
A series of different 1-monosubstituted and 1,1-disubstituted 1,2,3,4-tetrahydro-isoquinolines was synthesized in high yields from different ketoamides. We have developed a convenient method for the synthesis of disubstituted derivatives by interaction of ketoamides with organomagnesium compounds, followed by cyclization in the
Ljupčo Pejov et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 79(1), 27-34 (2011-03-23)
The 1:1 p-toluenesulfonic acid-water complex, p-toluenesulfonic acid itself and the p-toluenesulfonate anion were studied at HF and B3LYP/6-31+G(d,p) levels of theory. Full geometry optimizations of the aforementioned species reveal non-existence of ionic minima on the explored 1:1 p-toluenesulfonic acid-water complex
Ananda S Amarasekara et al.
Carbohydrate research, 346(17), 2820-2822 (2011-11-01)
The effects of adding D(2)SO(4), and p-toluenesulfonic acid-d to D-cellobiose dissolved in D(2)O were investigated at 23°C by plotting (13)C NMR chemical shift changes (Δδ) against the acid to D-cellobiose molar ratio. (13)C Chemical shifts of all 18 carbon signals
G Shanmugam et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 95, 177-183 (2012-05-29)
Bulk crystals of newly identified organic nonlinear optical material 4-methylanilinium p-toluenesulfonate (PMPT) were grown by slow evaporation solution growth method using ethanol as a solvent. It crystallizes in monoclinic system with a noncentrosymmetric space group P2(1). The formation of the
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