1-Chloro-4-fluorobenzene

C6H4ClFCAS 352-33-0130.55 g/mol

Open in Covalent MOL file
FCl
Aryl halide

Properties

Molecular formula
C6H4ClF
Molar mass
130.55 g/mol
Exact mass
129.9986 Da
Density
1.2355 g/mL (at 11.2 °C)
Melting point
−26.8 °C
Boiling point
130 °C
logP
2.48Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
352-33-0
SMILES
Fc1ccc(Cl)cc1
InChIKey
RJCGZNCCVKIBHO-UHFFFAOYSA-N
InChI
InChI=1S/C6H4ClF/c7-5-1-3-6(8)4-2-5/h1-4H

Weigh it out

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

Names and synonyms

10 names
  • Benzene, 1-chloro-4-fluoro-
  • 1-Fluoro-4-chlorobenzene
  • p-Chlorofluorobenzene
  • p-Fluorochlorobenzene
  • 4-Chlorofluorobenzene
  • 4-Fluorochlorobenzene
  • p-Monofluoromonochlorobenzene
  • 4-Fluorophenyl chloride
  • NSC 10272
  • 4-Fluoro-1-chlorobenzene

Work with 1-Chloro-4-fluorobenzene

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

1,4-Dichlorobenzene106-46-760 % similar 1,4-Difluorobenzene540-36-360 % similar 3,5-Difluorochlorobenzene1435-43-450 % similar 1,3-Dichloro-5-fluorobenzene1435-46-750 % similar 4,4′-Dichlorobiphenyl2050-68-250 % similar 4,4′-Difluorobiphenyl398-23-250 % similar 5-Chloro-2-fluoropyridine1480-65-546 % similar 4-Chlorobenzyl chloride104-83-645 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Chloro-2-fluorobenzene348-51-6 1-Chloro-3-fluorobenzene625-98-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook