3-(3-Fluorophenyl)benzaldehyde

C₁₃H₉FOCAS 400750-09-6200.21 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₁₃H₉FO
Molar mass: 200.21 g/mol
Exact mass: 200.0637 Da
logP: 3.31Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

400750-09-6

SMILES

C1=CC(=CC(=C1)C2=CC(=CC=C2)F)C=O

InChIKey

JKHXPCVGTFXSES-UHFFFAOYSA-N

InChI

InChI=1S/C13H9FO/c14-13-6-2-5-12(8-13)11-4-1-3-10(7-11)9-15/h1-9H

Weigh it out

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

Names and synonyms

1 names

3'-Fluorobiphenyl-3-carbaldehyde

Work with 3-(3-Fluorophenyl)benzaldehyde

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

3-Fluorobenzaldehyde456-48-477 % similar [1,1′-Biphenyl]-3-carboxaldehyde1204-60-068 % similar 3,3′-Difluoro-1,1′-biphenyl396-64-560 % similar 4'-Chlorobiphenyl-3-carbaldehyde139502-80-059 % similar 3-(Pyridin-4-yl)benzaldehyde208190-04-959 % similar 3-(3-Methylphenyl)benzaldehyde216443-78-659 % similar 3'-Trifluoromethylbiphenyl-3-carbaldehyde126091-24-559 % similar Isophthalaldehyde626-19-758 % similar

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

Same formula

3-(4-Fluorophenyl)benzaldehyde164334-74-1 2-(4-Fluorophenyl)benzaldehyde192863-46-0 2′-Fluoro[1,1′-biphenyl]-2-carboxaldehyde223575-95-9 2-Fluorobenzophenone342-24-5 3-Fluorobenzophenone345-69-7 4-Fluorobenzophenone345-83-5 3'-Fluoro-[1,1'-biphenyl]-4-carbaldehyde400750-63-2

Elsewhere

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