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About This Item
Empirical Formula (Hill Notation):
C6H4F3NS
CAS Number:
Molecular Weight:
179.16
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
5-(Trifluoromethyl)pyridine-2-thiol, 97%
InChI
1S/C6H4F3NS/c7-6(8,9)4-1-2-5(11)10-3-4/h1-3H,(H,10,11)
SMILES string
FC(F)(F)c1ccc(S)nc1
InChI key
YFSCXLSUZZXNHW-UHFFFAOYSA-N
assay
97%
mp
154-159 °C (lit.)
functional group
fluoro
storage temp.
2-8°C
Application
5-(Trifluoromethyl)pyridine-2-thiol may be used to synthesize 5-trifluoromethylpyridine-2-sulfonyl chloride by reacting with chlorine gas in HCl solution.
signalword
Warning
hcodes
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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"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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