4-Bromodibenzo[b,d]furan

C₁₂H₇BrOCAS 89827-45-2247.09 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₇BrO
Molar mass: 247.09 g/mol
Exact mass: 245.9680 Da
logP: 4.35Crippen estimate
Polar surface area: 13.1 Å²
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

89827-45-2

SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)Br

InChIKey

DYTYBRPMNQQFFL-UHFFFAOYSA-N

InChI

InChI=1S/C12H7BrO/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-Bromodibenzofuran

Work with 4-Bromodibenzo[b,d]furan

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

4,6-Dibromodibenzofuran201138-91-271 % similar 4-Dibenzofuranamine50548-43-157 % similar 4-Iododibenzofuran65344-26-557 % similar Dibenzofuran132-64-954 % similar 4-(3-Bromo-phenyl)-dibenzofuran887944-90-353 % similar Dibenzofuran-4-boronic acid100124-06-952 % similar 3-Bromo-1-benzofuran59214-70-947 % similar Cbzo1199616-66-444 % similar

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

Same formula

3-Bromodibenzofuran26608-06-0 1-Bromodibenzofuran50548-45-3 2-Bromodibenzofuran86-76-0

Elsewhere

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