chempirical

3-Fluoro-5-hydroxypicolinaldehyde

C6H4FNO2CAS 1227515-00-5141.10 g/mol

Open in Covalent MOL file
ONOHF
AldehydeAryl halidePhenol

Properties

Molecular formula
C6H4FNO2
Molar mass
141.10 g/mol
Exact mass
141.0226 Da
logP
0.74Crippen estimate
Polar surface area
50.2 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

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

Identifiers

CAS number
1227515-00-5
SMILES
O=Cc1ncc(O)cc1F
InChIKey
OCVRPSROKULOJE-UHFFFAOYSA-N
InChI
InChI=1S/C6H4FNO2/c7-5-1-4(10)2-8-6(5)3-9/h1-3,10H

Weigh it out

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Names and synonyms

2 names
  • 3-Fluoro-5-hydroxy-2-pyridinecarboxaldehyde
  • 2-Pyridinecarboxaldehyde, 3-fluoro-5-hydroxy-

Work with 3-Fluoro-5-hydroxypicolinaldehyde

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

2,6-Difluoro-4-hydroxybenzaldehyde532967-21-853 % similar 2-Chloro-3-fluoro-5-hydroxypyridine870062-76-350 % similar 2-Fluoro-4-hydroxybenzaldehyde348-27-649 % similar 3-Fluoro-2-pyridinecarboxaldehyde31224-43-846 % similar 4,5-Difluoro-2-hydroxybenzaldehyde199287-52-043 % similar 2,5-Difluoro-4-hydroxybenzaldehyde918523-99-642 % similar 3,5-Difluoro-4-hydroxybenzaldehyde118276-06-540 % similar 2,4,5-Trifluorobenzaldehyde165047-24-539 % similar

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

Same formula

5-Fluoropyridine-2-carboxylic acid107504-08-5 1-Fluoro-2-nitrobenzene1493-27-2 3-Fluoropyridine-2-carboxylic acid152126-31-3 4-Fluoronitrobenzene350-46-9 3-Fluoropyridine-4-carboxylic acid393-53-3 2-Fluoronicotinic acid393-55-5 2-Fluoroisonicotinic acid402-65-3 5-Fluoronicotinic acid402-66-4

Elsewhere

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