chempirical

2-Bromodibenzofuran

C12H7BrOCAS 86-76-0247.09 g/mol

Open in Covalent MOL file
BrO
Aryl halide

Properties

Molecular formula
C12H7BrO
Molar mass
247.09 g/mol
Exact mass
245.9680 Da
Melting point
110 °C
logP
4.35Crippen estimate
Polar surface area
13.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
86-76-0
SMILES
Brc1ccc2oc3ccccc3c2c1
InChIKey
CRJISNQTZDMKQD-UHFFFAOYSA-N
InChI
InChI=1S/C12H7BrO/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7H

Weigh it out

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

Names and synonyms

3 names
  • Dibenzofuran, 2-bromo-
  • NSC 1735
  • 2-Bromodibenzo[b,d]furan

Work with 2-Bromodibenzofuran

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

2,8-Dibromodibenzofuran10016-52-179 % similar 2-Dibenzofuranol86-77-160 % similar 3-Bromonaphtho[2,3-b]benzofuran1256544-32-759 % similar Dibenzofuran132-64-958 % similar 2-Dibenzofuransulfonic acid83863-63-246 % similar 3-Dibenzofuranamine4106-66-545 % similar Xanthone90-47-143 % similar 1-Chlorodibenzofuran84761-86-442 % similar

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

Same formula

1-Bromodibenzofuran50548-45-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook