chempirical

4,6-Dibromodibenzofuran

C12H6Br2OCAS 201138-91-2325.99 g/mol

Open in Covalent MOL file
BrOBr
Aryl halide

Properties

Molecular formula
C12H6Br2O
Molar mass
325.99 g/mol
Exact mass
323.8785 Da
logP
5.11Crippen estimate
Polar surface area
13.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

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
201138-91-2
SMILES
C1=CC2=C(C(=C1)Br)OC3=C2C=CC=C3Br
InChIKey
XSJLDNSNUICSQC-UHFFFAOYSA-N
InChI
InChI=1S/C12H6Br2O/c13-9-5-1-3-7-8-4-2-6-10(14)12(8)15-11(7)9/h1-6H

Weigh it out

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

Work with 4,6-Dibromodibenzofuran

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-Bromodibenzo[b,d]furan89827-45-271 % similar 1,5-Dibromonaphthalene7351-74-855 % similar 1-Bromodibenzofuran50548-45-346 % similar 4,6-Dibromodibenzothiophene669773-34-646 % similar 1-Bromonaphthalene90-11-946 % similar 1,3-Dibromo-2-chlorobenzene19230-27-445 % similar 1,4-Dibromonaphthalene83-53-445 % similar 7-Bromo-1-benzofuran133720-60-244 % similar

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

Same formula

2,8-Dibromodibenzofuran10016-52-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook