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104040-74-6

104040-74-6 Structure

104040-74-6 Structure
IdentificationMore
[Name]

3-(Trifluoromethyl)pyridine-2-thiol
[CAS]

104040-74-6
[Synonyms]

2-MERCAPTO-3-(TRIFLUOROMETHYL)PYRIDINE
BUTTPARK 45\03-86
3-(Trifluoromethyl)pyridine-2-thiol
3-(trifluoromethyl)-2-pyridinethiol
3-(Trifluoromethyl)-2(1H)-pyridinethione
3-(Trifluoromethyl)pyridine-2(1H)-thione
[EINECS(EC#)]

672-817-6
[Molecular Formula]

C6H4F3NS
[MDL Number]

MFCD00178749
[Molecular Weight]

179.16
[MOL File]

104040-74-6.mol
Chemical PropertiesBack Directory
[Melting point ]

178-183 °C
[Boiling point ]

145.3±50.0 °C(Predicted)
[density ]

1.43±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

solid
[pka]

8.33±0.40(Predicted)
[Appearance]

Light yellow to brown Solid
[InChI]

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

ACGSRAAAQJSWLC-UHFFFAOYSA-N
[SMILES]

FC(F)(F)c1cccnc1S
[CAS DataBase Reference]

104040-74-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN 2811 6.1 / PGIII
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

2933399990
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Hazard InformationBack Directory
[Uses]

3-(Trifluoromethyl)pyridine-2-thiol is a reagent used in synthesis of Flazasulfuron-d6. Flazasulfuron, is a Trifluoro-pyridine derivative acting as a pesticide.
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