chempirical

5-Fluorosalicylaldehyde

C7H5FO2CAS 347-54-6140.11 g/mol

Open in Covalent MOL file
FOOH
AldehydeAryl halidePhenol

Properties

Molecular formula
C7H5FO2
Molar mass
140.11 g/mol
Exact mass
140.0274 Da
logP
1.34Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
347-54-6
SMILES
C1=CC(=C(C=C1F)C=O)O
InChIKey
FDUBQNUDZOGOFE-UHFFFAOYSA-N
InChI
InChI=1S/C7H5FO2/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H

Weigh it out

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

Work with 5-Fluorosalicylaldehyde

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

2,5-Dihydroxybenzaldehyde1194-98-560 % similar 2,4-Difluorobenzaldehyde1550-35-260 % similar 2,5-Difluorobenzaldehyde2646-90-460 % similar 4-Hydroxyisophthalaldehyde3328-70-960 % similar 5-Bromosalicylaldehyde1761-61-156 % similar 5-Iodosalicylaldehyde1761-62-256 % similar 5-Bromosalicylaldehyde17691-61-156 % similar 5-Fluoro-2-methylbenzaldehyde22062-53-956 % similar

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

Same formula

2-Fluoro-4-hydroxybenzaldehyde348-27-6 4-Fluoro-2-hydroxybenzaldehyde348-28-7 6-Fluorosalicylaldehyde38226-10-7 3-Fluorosalicylaldehyde394-50-3 3-Fluoro-4-hydroxybenzaldehyde405-05-0 2-Fluorobenzoic acid445-29-4 3-Fluorobenzoic acid455-38-9 4-Fluorobenzoic acid456-22-4

Elsewhere

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