5-Chloro-2-fluorobenzaldehyde

C₇H₄ClFOCAS 96515-79-6158.56 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₇H₄ClFO
Molar mass: 158.56 g/mol
Exact mass: 157.9935 Da
logP: 2.29Crippen estimate
Polar surface area: 17.1 Å²
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

96515-79-6

SMILES

C1=CC(=C(C=C1Cl)C=O)F

InChIKey

WDTUCEMLUHTMCB-UHFFFAOYSA-N

InChI

InChI=1S/C7H4ClFO/c8-6-1-2-7(9)5(3-6)4-10/h1-4H

Weigh it out

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

Work with 5-Chloro-2-fluorobenzaldehyde

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-Difluorobenzaldehyde2646-90-460 % similar 2,5-Dichlorobenzaldehyde6361-23-560 % similar 2-Fluoro-5-iodobenzaldehyde146137-76-056 % similar 2-Bromo-5-chlorobenzaldehyde174265-12-456 % similar 2-Amino-5-chlorobenzaldehyde20028-53-956 % similar 5-Chlorosalicylaldehyde635-93-856 % similar 2-Fluoro-5-methylbenzaldehyde93249-44-656 % similar 5-Bromo-2-fluorobenzaldehyde93777-26-556 % similar

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

Same formula

3-Fluorobenzoyl chloride1711-07-5 3-Chloro-4-fluorobenzaldehyde34328-61-5 2-Chloro-6-fluorobenzaldehyde387-45-1 2-Fluorobenzoyl chloride393-52-2 4-Fluorobenzoyl chloride403-43-0 4-Chloro-3-fluorobenzaldehyde5527-95-7 4-Chloro-2-fluorobenzaldehyde61072-56-8 2-Chloro-5-fluorobenzaldehyde84194-30-9

Elsewhere

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