chempirical

2-Iododibenzofuran

C12H7IOCAS 5408-56-0294.09 g/mol

Open in Covalent MOL file
OI
Aryl halide

Properties

Molecular formula
C12H7IO
Molar mass
294.09 g/mol
Exact mass
293.9542 Da
logP
4.19Crippen 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
5408-56-0
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)I
InChIKey
MNKSJEJNCQWHFE-UHFFFAOYSA-N
InChI
InChI=1S/C12H7IO/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.

Work with 2-Iododibenzofuran

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

Dibenzofuran132-64-958 % similar 2-Bromodibenzofuran86-76-055 % similar 2-Dibenzofuranol86-77-155 % similar Dibenzo(b,d)furan-2-ylboronic Acid (contains varying amounts of Anhydride)402936-15-650 % similar 2-Dibenzofuransulfonic acid83863-63-246 % similar 3-Iodocarbazole16807-13-945 % similar 2-Iododibenzothiophene177586-41-345 % similar 3-Bromodibenzofuran26608-06-045 % similar

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

Same formula

4-Iododibenzofuran65344-26-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook