2,3-Difluoro-4-hydroxybenzaldehyde

C₇H₄F₂O₂CAS 676500-39-3158.10 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₄F₂O₂
Molar mass: 158.10 g/mol
Exact mass: 158.0179 Da
logP: 1.48Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
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

676500-39-3

SMILES

C1=CC(=C(C(=C1C=O)F)F)O

InChIKey

KTGPDDPEVRJSFY-UHFFFAOYSA-N

InChI

InChI=1S/C7H4F2O2/c8-6-4(3-10)1-2-5(11)7(6)9/h1-3,11H

Weigh it out

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

Work with 2,3-Difluoro-4-hydroxybenzaldehyde

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

2,3,4-Trifluorobenzaldehyde161793-17-561 % similar 2,3-Difluoro-4-methylbenzaldehyde245536-50-957 % similar 4-Bromo-2,3-difluorobenzaldehyde644985-24-057 % similar 5-Fluorosalicylaldehyde347-54-655 % similar 2,5-Dihydroxybenzaldehyde1194-98-553 % similar 2,3,4-Trihydroxybenzaldehyde2144-08-352 % similar 4-Fluoro-2-hydroxybenzaldehyde348-28-752 % similar 2,3,4-Trifluorophenol2822-41-550 % similar

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

Same formula

3,5-Difluoro-4-hydroxybenzaldehyde118276-06-5 2,4-Difluorobenzoic acid1583-58-0 2,2-Difluoro-1,3-benzodioxole1583-59-1 4,5-Difluoro-2-hydroxybenzaldehyde199287-52-0 2,5-Difluorobenzoic acid2991-28-8 2,6-Difluorobenzoic acid385-00-2 2,3-Difluorobenzoic acid4519-39-5 3,5-Difluorobenzoic acid455-40-3

Elsewhere

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