Flonicamid

C9H6F3N3OCAS 158062-67-0229.16 g/mol

Open in Covalent MOL file
NNHONFFF
Alkyl halideNitrile

Properties

Molecular formula
C9H6F3N3O
Molar mass
229.16 g/mol
Exact mass
229.0463 Da
Density
1.531 g/mL (at 20 °C)
Melting point
157.5 °C
pKa
11.6
logP
1.93Crippen estimate
Polar surface area
69.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Harmonised EU classification (CLP Annex VI, index 616-216-00-9), via PubChem.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
158062-67-0
SMILES
N#CCN=C(O)c1cnccc1C(F)(F)F
InChIKey
RLQJEEJISHYWON-UHFFFAOYSA-N
InChI
InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

14 names · show all
  • 3-Pyridinecarboxamide, N-(cyanomethyl)-4-(trifluoromethyl)-
  • F 1785
  • Carbine
  • F 1785-03-1
  • Aria
  • Teppeki
  • Beleaf
  • Ulala
  • Carbine (insecticide)
  • Ulala DF
  • Aria (insecticide)
  • N-Cyanomethyl-4-(trifluoromethyl)nicotinamide
  • N-(Cyanomethyl)-4-(trifluoromethyl)-3-pyridinecarboxamide
  • IKI 220

Work with Flonicamid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Trifluoromethylnicotinamide158062-71-650 % similar 4-(Trifluoromethyl)nicotinic acid158063-66-250 % similar N-Hydroxy-4-(trifluoromethyl)-3-pyridinecarboximidamide175204-85-047 % similar 4-(Trifluoromethyl)-3-pyridinecarbonitrile13600-43-643 % similar Methyl 4-(trifluoromethyl)nicotinate175204-82-741 % similar 3-(Trifluoromethyl)isonicotinic acid590371-38-341 % similar 3-Bromo-4-(trifluoromethyl)pyridine936841-70-240 % similar 3-Fluoro-4-(trifluoromethyl)pyridine113770-87-938 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia