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The chemical compound "2-[(4-fluorobenzyl)amino]-2-oxoethyl [4-(4-methylphenyl)-2-thioxo-1,3-thiazol-3(2H)-yl]acetate" is a complex organic molecule with a molecular formula of C22H18FN3O3S2. It features a benzylamine group attached to a 2-oxoethyl moiety, which is further connected to a 1,3-thiazole ring system. The thiazole ring contains a 4-methylphenyl group and a 2-thioxo functional group, indicating the presence of a sulfur atom double-bonded to oxygen. 2-[(4-fluorobenzyl)amino]-2-oxoethyl [4-(4-methylphenyl)-2-thioxo-1,3-thiazol-3(2H)-yl]acetate is characterized by its fluorine atom in the benzyl group, which may influence its reactivity and physical properties. The compound's structure suggests potential applications in pharmaceuticals or as a chemical intermediate, although specific uses would depend on its properties and reactivity.

5487-13-8

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5487-13-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5487-13-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,8 and 7 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 5487-13:
(6*5)+(5*4)+(4*8)+(3*7)+(2*1)+(1*3)=108
108 % 10 = 8
So 5487-13-8 is a valid CAS Registry Number.

5487-13-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-[4-(4-methylphenyl)-2-sulfanylidene-1,3-thiazol-3-yl]acetate

1.2 Other means of identification

Product number -
Other names mercury diselenocyanate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:5487-13-8 SDS

5487-13-8Relevant academic research and scientific papers

Solid-State 199Hg MAS NMR Studies of Mercury(II) Thiocyanate Complexes and Related Compounds. Crystal Structure of Hg(SeCN)2

Bowmaker, Graham A.,Churakov, Andrei V.,Harris, Robin K.,Howard, Judith A. K.,Apperley, David C.

, p. 1734 - 1743 (2008/10/08)

The solid-state 199Hg MAS NMR spectra of [Hg(SCN)2], [Hg(SeCN)2], M[Hg(SCN)3), M2[Hg(SCN)4] (M = K, Cs), and K2[Hg3(NCO)8] have been measured, and the (monoclinic) crystal structure of [Hg(SeCN)2] has been determined to assist in the interpretation of the NMR data. The asymmetric unit of Hg(SeCN)2 contains one molecule at an inversion center which shows linear Se-Hg-Se bonding (Hg-Sc = 2.4738(10) ?, Se-Hg-Se = 180°, Hg-Se-C = 97.5(3)°). Secondary Hg-Se and Hg-N contacts are 3.4246(9) and 2.835(12) ?, respectively; this arrangement differs from that in Hg(SCN)2 where there are no secondary Hg-S contacts. A redetermination of the monoclinic crystal structure of K[Hg(SCN)3] is also reported, revealing substantial differences from the earlier work. Spinning sideband analysis has been used to determine the 199Hg shielding anisotropy and asymmetry parameters Δσ and η; from the solid-state 199Hg MAS NMR spectra. The effects of changes in the mercury coordination number and of distortion of the coordination environment on the shielding parameters are interpreted in terms of changes in the local paramagnetic contribution. The same method is employed to assess the effects of secondary bonding on shielding, and it is shown that the substantial differences between the values for Hg(SCN)2 and Hg(SeCN)2 can be attributed to these effects. The ν(HgS) modes have been assigned in the IR and Raman spectra of the thiocyanate complexes, and the correlation between the wavenumbers and splittings of these bands and the 119Hg shielding parameters is discussed.

SYNTHESIS AND STUDIES OF CuHg(NCX)4 (X=S, Se) AND THEIR COMPLEXES AND APPLICATION OF THE SOFTNESS PARAMETER IN THE ELUCIDATION OF THEIR STUCTURE

Singh, P. P.,Pal, R. B.,Srivastava, A. K.

, p. 303 - 316 (2007/10/02)

Complexes of CuHg(NCS)4, CuHg(NCS)2 (NCSe)2 and CuHg(NCSe)4 with tetrahydrofuran, dioxan, pyridine, 2-aminopyridine, nicotinamide, bipyridine and phenanthroline have been prepared and comparative studies made.Bipyridine and phenanthroline form cationic-an

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