chempirical

4-Iododibenzofuran

C12H7IOCAS 65344-26-5294.09 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
65344-26-5
SMILES
C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)I
InChIKey
ACEYZYYNAMWIIE-UHFFFAOYSA-N
InChI
InChI=1S/C12H7IO/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7H

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Names and synonyms

1 names
  • 4-Iododibenzo-[B,D]furan

Work with 4-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

4-Bromodibenzo[b,d]furan89827-45-257 % similar 4-Dibenzofuranamine50548-43-155 % similar Dibenzofuran132-64-952 % similar Dibenzofuran-4-boronic acid100124-06-950 % similar 1-Iodonaphthalene90-14-245 % similar 4-(3-Bromo-phenyl)-dibenzofuran887944-90-344 % similar Cbzo1199616-66-443 % similar 6-Chloro-8-oxa-3,5-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),3,5,10,12-hexaene39876-88-543 % similar

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

Same formula

2-Iododibenzofuran5408-56-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook