chempirical

6-Chloro-2,3-difluorobenzaldehyde

C7H3ClF2OCAS 797791-33-4176.55 g/mol

Open in Covalent MOL file
FFOCl
AldehydeAryl halide

Properties

Molecular formula
C7H3ClF2O
Molar mass
176.55 g/mol
Exact mass
175.9840 Da
logP
2.43Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
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
797791-33-4
SMILES
C1=CC(=C(C(=C1F)F)C=O)Cl
InChIKey
YVKZXQCYLHFHIR-UHFFFAOYSA-N
InChI
InChI=1S/C7H3ClF2O/c8-5-1-2-6(9)7(10)4(5)3-11/h1-3H

Weigh it out

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

Work with 6-Chloro-2,3-difluorobenzaldehyde

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

2,3,6-Trifluorobenzaldehyde104451-70-968 % similar 6-Chloro-2-fluoro-3-methylbenzaldehyde286474-59-764 % similar 2-Chloro-6-fluorobenzaldehyde387-45-161 % similar 6-Bromo-2,3-difluorobenzaldehyde360576-04-158 % similar 2,3,4-Trifluorochlorobenzene36556-42-055 % similar 2,3,5,6-Tetrafluorobenzaldehyde19842-76-353 % similar 2,3-Difluoro-6-methoxybenzaldehyde187543-87-953 % similar 2,6-Dichlorobenzaldehyde83-38-552 % similar

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

Same formula

3-Chloro-2,4-difluorobenzaldehyde127675-46-1 3,5-Difluorobenzoyl chloride129714-97-2 2-Chloro-4,5-difluorobenzaldehyde165047-23-4 2,6-Difluorobenzoyl chloride18063-02-0 2,3-Difluorobenzoyl chloride18355-73-2 3-Chloro-2,6-difluorobenzaldehyde190011-87-1 4-Chloro-2,6-difluorobenzaldehyde252004-45-8 2-Chloro-3,6-difluorobenzaldehyde261762-39-4

Elsewhere

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