4-[(3-Fluorophenyl)methoxy]benzaldehyde

C14H11FO2CAS 66742-57-2230.24 g/mol

Open in Covalent MOL file
OOF
AldehydeAryl halideEther

Properties

Molecular formula
C14H11FO2
Molar mass
230.24 g/mol
Exact mass
230.0743 Da
Melting point
40–41 °C
logP
3.22Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

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
66742-57-2
SMILES
O=Cc1ccc(OCc2cccc(F)c2)cc1
InChIKey
DNKSIIHRKWTIRH-UHFFFAOYSA-N
InChI
InChI=1S/C14H11FO2/c15-13-3-1-2-12(8-13)10-17-14-6-4-11(9-16)5-7-14/h1-9H,10H2

Weigh it out

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

Names and synonyms

2 names
  • Benzaldehyde, 4-[(3-fluorophenyl)methoxy]-
  • 4-(3-Fluorobenzyloxy)benzaldehyde

Work with 4-[(3-Fluorophenyl)methoxy]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

4-(Benzyloxy)benzaldehyde4397-53-967 % similar 4-[(3,4-Dichlorobenzyl)oxy]benzaldehyde66742-56-161 % similar 4-[(2-Chloro-6-fluorophenyl)methoxy]benzaldehyde172932-10-457 % similar 4-[(4-Bromophenyl)methoxy]benzaldehyde149833-95-454 % similar 3-Benzyloxybenzaldehyde1700-37-454 % similar 3,5-Dibenzyloxybenzaldehyde14615-72-653 % similar 3'-Fluoro-[1,1'-biphenyl]-4-carbaldehyde400750-63-251 % similar 4-(4-Fluorophenoxy)benzaldehyde137736-06-250 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Fluoro-4'-methoxybenzophenone345-89-1 4-[(4-Fluorophenyl)methoxy]benzaldehyde56442-17-2 2-Fluoro-4'-methoxybenzophenone66938-29-2 4-[(2-Fluorophenyl)methoxy]benzaldehyde70627-20-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook