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Sigma-Aldrich

4-(Trifluoromethyl)pyrimidine-2-thiol

96%

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About This Item

Empirical Formula (Hill Notation):
C5H3F3N2S
CAS Number:
136547-17-6
Molecular Weight:
180.15
MDL number:
MFCD00115113
UNSPSC Code:
12352100
PubChem Substance ID:
24865477
NACRES:
NA.22

assay

96%

form

solid

mp

164-166 °C (lit.)

functional group

fluoro

SMILES string

FC(F)(F)c1ccnc(S)n1

InChI

1S/C5H3F3N2S/c6-5(7,8)3-1-2-9-4(11)10-3/h1-2H,(H,9,10,11)

InChI key

HDGJASCXBNRLGA-UHFFFAOYSA-N

General description

4-(Trifluoromethyl)pyrimidine-2-thiol is a heteroaromatic thioamide. Separation and quantification of a mixture of heteroaromatic thioamides (pyridine-2-thione, 5-trifluoromethylpyridine-2-thione, pyrimidine-2-thiol, 4-trifluoromethylpyrimidine-2-thiol) by capillary zone electrophoresis has been reported.

Application

4-(Trifluoromethyl)pyrimidine-2-thiol may be used in the preparation of [{Pt(bzq)(μ-L)}2] [Hbzq = benzo[h]quinolone, HL = 4-(trifluoromethyl)pyrimidine-2-thiol], a novel half-lantern divalent complex of platinum.

pictograms

Skull and crossbones
GHS06

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

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Certificates of Analysis (COA)

Lot/Batch Number
MKCC2557
1394492
00512CJ
04703TH
U17531

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Electrophoretic determination of thioamides, pyridine and pyrimidine derivatives.
Chenov'yants MS, et al.
Journal of Analytical Chemistry, 68(6), 532-535 (2013)
Stayin' Alive-Organoplatinum Complexes.
Klein A.
Inorganics , 3(2), 155-159 (2015)
Half-Lantern Pt (II) and Pt (III) Complexes. New Cyclometalated Platinum Derivatives.
Sicilia V, et al.
Inorganics , 2(3), 508-523 (2014)

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