chempirical

3-Bromodibenzofuran

C12H7BrOCAS 26608-06-0247.09 g/mol

Open in Covalent MOL file
OBr
Aryl halide

Properties

Molecular formula
C12H7BrO
Molar mass
247.09 g/mol
Exact mass
245.9680 Da
logP
4.35Crippen 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
26608-06-0
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)Br
InChIKey
AZFABGHLDGJASW-UHFFFAOYSA-N
InChI
InChI=1S/C12H7BrO/c13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8/h1-7H

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

Work with 3-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

3-Bromonaphtho[2,3-b]benzofuran1256544-32-770 % similar 2-Bromobenzo(b)naphtho(2,3-d)furan1627917-16-159 % similar 2,8-Dibromodibenzofuran10016-52-159 % similar Dibenzofuran132-64-958 % similar 2-Bromobenzo[9,10]phenanthrene19111-87-656 % similar 2,7-Dibromotriphenylene888041-37-056 % similar 3-Dibenzofuranamine4106-66-555 % similar 8-Bromo-1-chlorodibenzo[B,D]furan2225909-61-351 % similar

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

Same formula

1-Bromodibenzofuran50548-45-3 2-Bromodibenzofuran86-76-0 4-Bromodibenzo[b,d]furan89827-45-2

Elsewhere

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