chempirical

2-Fluoro-3-pyridinecarboxaldehyde

C6H4FNOCAS 36404-90-7125.10 g/mol

Open in Covalent MOL file
ONF
AldehydeAryl halide

Properties

Molecular formula
C6H4FNO
Molar mass
125.10 g/mol
Exact mass
125.0277 Da
Boiling point
50 °C (at 3 Torr)
logP
1.03Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
36404-90-7
SMILES
O=Cc1cccnc1F
InChIKey
OFBVGDCXXGXDKU-UHFFFAOYSA-N
InChI
InChI=1S/C6H4FNO/c7-6-5(4-9)2-1-3-8-6/h1-4H

Weigh it out

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

Names and synonyms

5 names
  • 3-Pyridinecarboxaldehyde, 2-fluoro-
  • 2-Fluoropyridine-3-carboxaldehyde
  • 2-Fluoro-3-formylpyridine
  • 2-Fluoronicotinaldehyde
  • 2-Fluoropyridine-3-carbaldehyde

Work with 2-Fluoro-3-pyridinecarboxaldehyde

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

2-Bromonicotinaldehyde128071-75-055 % similar 2,3-Difluoropyridine1513-66-248 % similar 2-Fluoro-3-methylpyridine2369-18-847 % similar 2-Fluorobenzaldehyde446-52-647 % similar 2-Fluoro-3-iodopyridine113975-22-745 % similar 2-Fluoro-3-pyridinol174669-74-045 % similar 2,3-Difluorobenzaldehyde2646-91-542 % similar Pyridine-2-carbaldehyde1121-60-442 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Fluoronicotinaldehyde39891-04-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook