chempirical

1,1′-Oxybis[4-fluorobenzene]

C12H8F2OCAS 330-93-8206.19 g/mol

Open in Covalent MOL file
FOF
Aryl halideEther

Properties

Molecular formula
C12H8F2O
Molar mass
206.19 g/mol
Exact mass
206.0543 Da
logP
3.76Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
330-93-8
SMILES
Fc1ccc(Oc2ccc(F)cc2)cc1
InChIKey
UUKHFGSOCZLVJO-UHFFFAOYSA-N
InChI
InChI=1S/C12H8F2O/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H

Weigh it out

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

Names and synonyms

8 names
  • Benzene, 1,1′-oxybis[4-fluoro-
  • Ether, bis(p-fluorophenyl)
  • Bis(4-fluorophenyl) ether
  • Bis(p-fluorophenyl) ether
  • 4,4′-Difluorodiphenyl ether
  • NSC 51793
  • 1-Fluoro-4-(4-fluorophenoxy)benzene
  • 4,4'-Difluorodiphenyl ether

Work with 1,1′-Oxybis[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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Fluoro-4-phenoxybenzene330-84-779 % similar 4-(4-Fluorophenoxy)benzaldehyde137736-06-263 % similar 1,4-Difluorobenzene540-36-360 % similar 4-Fluoroanisole459-60-957 % similar 3-Bromo-4'-fluorodiphenyl ether50904-38-656 % similar 1-Fluoro-4-(trifluoromethoxy)benzene352-67-052 % similar 4,4′-Difluorobiphenyl398-23-250 % similar 1-Ethoxy-4-fluorobenzene459-26-750 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook