6-Fluoro-3,4-dihydro-3-oxo-2-pyrazinecarbonitrile

C5H2FN3OCAS 356783-31-8139.09 g/mol

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NNFNHO
Aryl halideNitrilePhenol

Properties

Molecular formula
C5H2FN3O
Molar mass
139.09 g/mol
Exact mass
139.0182 Da
logP
0.19Crippen estimate
Polar surface area
69.8 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
356783-31-8
SMILES
N#Cc1nc(F)cnc1O
InChIKey
LJZHACRGZWYTAX-UHFFFAOYSA-N
InChI
InChI=1S/C5H2FN3O/c6-4-2-8-5(10)3(1-7)9-4/h2H,(H,8,10)

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Names and synonyms

4 names
  • 6-Fluoro-3-oxo-3,4-dihydro-2-pyrazinecarbonitrile
  • 6-Fluoro-3-hydroxypyrazine-2-carbonitrile
  • 2-Pyrazinecarbonitrile, 6-fluoro-3,4-dihydro-3-oxo-
  • Pyrazinecarbonitrile, 6-fluoro-3,4-dihydro-3-oxo-

Work with 6-Fluoro-3,4-dihydro-3-oxo-2-pyrazinecarbonitrile

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

3,6-Difluoropyrazine-2-carbonitrile356783-28-365 % similar Favipiravir259793-96-941 % similar 2-Fluoropyridine-5-carbonitrile3939-12-640 % similar 2-Cyano-3,5-difluoropyridine298709-29-238 % similar 3,6-Dichloropyrazine-2-carbonitrile356783-16-938 % similar 2,3-Dicyanopyrazine13481-25-937 % similar 5-Hydroxy-3-methylpyridine-2-carbonitrile228867-86-536 % similar 5-Bromo-3-fluoro-2-pyridinecarbonitrile886373-28-036 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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