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590762

Sigma-Aldrich

5-(Trifluoromethyl)pyridine-2-thiol

97%

Synonym(s):

5-(Trifluoromethyl)-2-mercaptopyridine, 5-(Trifluoromethyl)-2-pyridinethiol

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About This Item

Empirical Formula (Hill Notation):
C6H4F3NS
CAS Number:
76041-72-0
Molecular Weight:
179.16
MDL number:
MFCD00128893
UNSPSC Code:
12352100
PubChem Substance ID:
24881297
NACRES:
NA.22

assay

97%

mp

154-159 °C (lit.)

storage temp.

2-8°C

SMILES string

FC(F)(F)c1ccc(S)nc1

InChI

1S/C6H4F3NS/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)

InChI key

YFSCXLSUZZXNHW-UHFFFAOYSA-N

Application

5-(Trifluoromethyl)pyridine-2-thiol may be used to synthesize 5-trifluoromethylpyridine-2-sulfonyl chloride by reacting with chlorine gas in HCl solution.

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_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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"Synthesis of [14C]-and [13C6]-labeled tipranavir and its potential hydroxyl metabolite and the glucuronide conjugate"
Latli B, et al.
Journal of Labelled Compounds & Radiopharmaceuticals, 51(08), 314- 320 (2008)

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