chempirical

4-Fluorobenzaldehyde

C7H5FOCAS 459-57-4124.11 g/mol

Open in Covalent MOL file
OF
AldehydeAryl halide

Properties

Molecular formula
C7H5FO
Molar mass
124.11 g/mol
Exact mass
124.0324 Da
Melting point
−10 °C
Boiling point
181.5 °C
logP
1.64Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
459-57-4
SMILES
O=Cc1ccc(F)cc1
InChIKey
UOQXIWFBQSVDPP-UHFFFAOYSA-N
InChI
InChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H

Weigh it out

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

Names and synonyms

5 names
  • Benzaldehyde, 4-fluoro-
  • Benzaldehyde, p-fluoro-
  • p-Fluorobenzaldehyde
  • p-Fluorobenzenecarboxaldehyde
  • NSC 68095

Work with 4-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-[(4-Fluorophenyl)methoxy]benzaldehyde56442-17-260 % similar [1,1′-Biphenyl]-4,4′-dicarboxaldehyde66-98-857 % similar 3,5-Difluorobenzaldehyde32085-88-457 % similar 3,4-Difluorobenzaldehyde34036-07-256 % similar 3-(4-Fluorophenyl)-2-propenal24654-55-554 % similar 4-(Difluoromethoxy)benzaldehyde73960-07-352 % similar Benzaldehyde100-52-750 % similar 4-Methylbenzaldehyde104-87-050 % similar

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

Same formula

2-Fluorobenzaldehyde446-52-6 Benzoyl fluoride455-32-3 3-Fluorobenzaldehyde456-48-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook