3-Chloro-2-fluorobenzaldehyde

C₇H₄ClFOCAS 85070-48-0158.56 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

Identifiers

CAS number

85070-48-0

SMILES

O=Cc1cccc(Cl)c1F

InChIKey

YAOZCMANASAVFN-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

2 names

Benzaldehyde, 3-chloro-2-fluoro-
2-Fluoro-3-chlorobenzaldehyde

Work with 3-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

2,3-Dichlorobenzaldehyde6334-18-564 % similar 2-Chlorobenzaldehyde89-98-563 % similar 2,3-Difluorobenzaldehyde2646-91-562 % similar 1,3-Dichloro-2-fluorobenzene2268-05-556 % similar 2-Fluoro-3-(trifluoromethyl)benzaldehyde112641-20-055 % similar 3-Chloro-2-fluoro-5-(trifluoromethyl)benzaldehyde261763-02-454 % similar 2-Fluoro-3-methoxybenzaldehyde103438-88-653 % similar B-(2-Fluoro-3-formylphenyl)boronic acid849061-98-953 % 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 2-Chloro-4-fluorobenzaldehyde84194-36-5

Elsewhere

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