3-Cyano-6-(trifluoromethyl)pyrid-2-one

Modify Date: 2025-08-24 20:36:43

3-Cyano-6-(trifluoromethyl)pyrid-2-one Structure
3-Cyano-6-(trifluoromethyl)pyrid-2-one structure
Common Name 3-Cyano-6-(trifluoromethyl)pyrid-2-one
CAS Number 116548-04-0 Molecular Weight 188.107
Density 1.5±0.1 g/cm3 Boiling Point 339.4±42.0 °C at 760 mmHg
Molecular Formula C7H3F3N2O Melting Point 210-211ºC
MSDS N/A Flash Point 159.0±27.9 °C

 Names

Name 2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 339.4±42.0 °C at 760 mmHg
Melting Point 210-211ºC
Molecular Formula C7H3F3N2O
Molecular Weight 188.107
Flash Point 159.0±27.9 °C
Exact Mass 188.019745
PSA 56.65000
LogP 2.09
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.494
InChIKey DSSUGBUBVKFSPP-UHFFFAOYSA-N
SMILES N#Cc1ccc(C(F)(F)F)[nH]c1=O

 Safety Information

Hazard Codes Xi:Irritant;
HS Code 2933399090

 Synthetic Route

~75%

3-Cyano-6-(trifluoromethyl)pyrid-2-one Structure

3-Cyano-6-(trif...

CAS#:116548-04-0

Literature: Journal of Medicinal Chemistry, , vol. 55, # 19 p. 8392 - 8408,17 Journal of Medicinal Chemistry, , vol. 55, # 19 p. 8392 - 8408

~51%

3-Cyano-6-(trifluoromethyl)pyrid-2-one Structure

3-Cyano-6-(trif...

CAS#:116548-04-0

Literature: Helvetica Chimica Acta, , vol. 71, # 3 p. 596 - 601

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

2-Hydroxy-6-trifluoromethyl-nicotinonitrile
3-pyridinecarbonitrile, 1,2-dihydro-2-oxo-6-(trifluoromethyl)-
2-hydroxy-6-(trifluoromethyl)nicotinonitrile
2-Oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
3-Cyano-6-(trifluoromethyl)pyrid-2-one
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