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71747

Sodium ionophore X

Selectophore™, function tested

Synonym(s):

4-tert-Butylcalix[4]arene-tetraacetic acid tetraethyl ester

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About This Item

Empirical Formula (Hill Notation):
C60H80O12
CAS Number:
97600-39-0
Molecular Weight:
993.27
UNSPSC Code:
26111700
NACRES:
NB.61
PubChem Substance ID:
329763493
MDL number:
MFCD00145373
Beilstein/REAXYS Number:
3587002
Form:
crystals
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description

for ion-selective electrodes

Quality Level

200

product line

Selectophore™

form

crystals

quality

function tested

SMILES string

CCOC(=O)COc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc1cc(c2)C(C)(C)C)c5OCC(=O)OCC)C(C)(C)C)c4OCC(=O)OCC)C(C)(C)C)c3OCC(=O)OCC)C(C)(C)C

InChI

1S/C60H80O12/c1-17-65-49(61)33-69-53-37-21-39-27-46(58(8,9)10)29-41(54(39)70-34-50(62)66-18-2)23-43-31-48(60(14,15)16)32-44(56(43)72-36-52(64)68-20-4)24-42-30-47(59(11,12)13)28-40(55(42)71-35-51(63)67-19-3)22-38(53)26-45(25-37)57(5,6)7/h25-32H,17-24,33-36H2,1-16H3

InChI key

HZHADWCIBZZJNV-UHFFFAOYSA-N

General description

Sodium ionophore X is generally used in the preparation of ion-selective electrode (ISE).
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Application

It may be used in a comparison study of ISE-based electronic tongue for direct and two-stage data analysis on Artificial Neural Network (ANN), Partial Least Squares-Discriminant Analysis (PLS-DA)) and Principal Components Analysis (PCA).
Selected application examples

Packaging

Bottomless glass bottle. Contents are inside inserted fused cone.

Other Notes

Ionophore employed in solid-state and polymeric membrane sodium-selective electrodes

Legal Information

Selectophore is a trademark of Merck KGaA, Darmstadt, Germany

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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Certificates of Analysis (COA)

Lot/Batch Number
BCCP4494
BCCK8363
BCCG1530
BCCB3955
BCBQ7949V

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D. Diamond et al.
Analyst, 114, 1551-1551 (1989)
Analytical Chemistry, 64, 2496-2496 (1992)
Direct and two-stage data analysis procedures based on PCA, PLS-DA and ANN for ISE-based electronic tongue-Effect of supervised feature extraction.
Ciosek P
Talanta, 67(3), 590-596 (2005)
View All Related Papers

Global Trade Item Number

SKUGTIN
71747-50MG04061832851822