4-(3-Bromo-phenyl)-dibenzofuran

C₁₈H₁₁BrOCAS 887944-90-3323.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₈H₁₁BrO
Molar mass: 323.19 g/mol
Exact mass: 321.9993 Da
logP: 6.02Crippen estimate
Polar surface area: 13.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

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

887944-90-3

SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C4=CC(=CC=C4)Br

InChIKey

OZXHBCWVDDLENO-UHFFFAOYSA-N

InChI

InChI=1S/C18H11BrO/c19-13-6-3-5-12(11-13)14-8-4-9-16-15-7-1-2-10-17(15)20-18(14)16/h1-11H

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Names and synonyms

1 names

4-(3-Bromophenyl)dibenzofuran

Work with 4-(3-Bromo-phenyl)-dibenzofuran

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-(Dibenzo[B,D]furan-4-yl)phenyl)boronic acid1271726-52-360 % similar 4-Bromodibenzo[b,d]furan89827-45-253 % similar 3-Bromodibenzofuran26608-06-051 % similar 2-Bromodibenzofuran86-76-051 % similar 4-(3-Bromophenyl)dibenzo[b,d]thiophene1084334-28-049 % similar 2-(3-Bromophenyl)triphenylene1313514-53-247 % similar 2-(3-Bromophenyl)benzoxazole99586-31-947 % similar 3-Bromobiphenyl2113-57-746 % similar

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

Elsewhere

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