4-Fluoro-3-phenoxybenzaldehyde

C₁₃H₉FO₂CAS 68359-57-9216.21 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Ether

Properties

Molecular formula: C₁₃H₉FO₂
Molar mass: 216.21 g/mol
Exact mass: 216.0587 Da
logP: 3.43Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Identifiers

CAS number

68359-57-9

SMILES

O=Cc1ccc(F)c(Oc2ccccc2)c1

InChIKey

JDICMOLUAHZVDS-UHFFFAOYSA-N

InChI

InChI=1S/C13H9FO2/c14-12-7-6-10(9-15)8-13(12)16-11-4-2-1-3-5-11/h1-9H

Weigh it out

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

Names and synonyms

2 names

Benzaldehyde, 4-fluoro-3-phenoxy-
3-Phenoxy-4-fluorobenzaldehyde

Work with 4-Fluoro-3-phenoxybenzaldehyde

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

4-Fluoro-3-methoxybenzaldehyde128495-46-559 % similar 4-Phenoxybenzaldehyde67-36-756 % similar 3-Phenoxybenzaldehyde39515-51-056 % similar 2-Fluorodiphenyl ether124330-20-753 % similar 3,4-Difluorobenzaldehyde34036-07-253 % similar 2-Phenoxybenzaldehyde19434-34-549 % similar 3-Fluoro-4-methoxybenzaldehyde351-54-248 % similar 3-Chloro-4-fluorobenzaldehyde34328-61-547 % similar

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

Same formula

2'-Fluorobiphenyl-3-carboxylic acid103978-23-0 4′-Fluoro[1,1′-biphenyl]-3-carboxylic acid10540-39-3 4-(4-Fluorophenoxy)benzaldehyde137736-06-2 3′-Fluoro[1,1′-biphenyl]-3-carboxylic acid168619-04-3 4′-Fluoro[1,1′-biphenyl]-2-carboxylic acid1841-57-2 3′-Fluoro[1,1′-biphenyl]-4-carboxylic acid1841-58-3 4-Fluoro-4′-hydroxybenzophenone25913-05-7

Elsewhere

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