chempirical

2-(4-Fluorophenyl)benzaldehyde

C13H9FOCAS 192863-46-0200.21 g/mol

Open in Covalent MOL file
OF
AldehydeAryl 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 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
192863-46-0
SMILES
C1=CC=C(C(=C1)C=O)C2=CC=C(C=C2)F
InChIKey
QENDTDXVOJYDLG-UHFFFAOYSA-N
InChI
InChI=1S/C13H9FO/c14-12-7-5-10(6-8-12)13-4-2-1-3-11(13)9-15/h1-9H

Weigh it out

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

Work with 2-(4-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

[1,1′-Biphenyl]-2-carboxaldehyde1203-68-568 % similar 2-(4-Pyridinyl)benzaldehyde176526-00-459 % similar 2-Fluorobenzaldehyde446-52-648 % similar 4-Fluorobenzaldehyde459-57-447 % similar 4-Fluorobiphenyl324-74-345 % similar 4′-Fluoro[1,1′-biphenyl]-2-carboxylic acid1841-57-245 % similar 2,4-Difluorobenzaldehyde1550-35-244 % similar 2-Bromo-4-fluorobenzaldehyde59142-68-642 % similar

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

Same formula

3-(4-Fluorophenyl)benzaldehyde164334-74-1 2′-Fluoro[1,1′-biphenyl]-2-carboxaldehyde223575-95-9 2-Fluorobenzophenone342-24-5 4-Fluorobenzophenone345-83-5

Elsewhere

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