chempirical

1,4-Dibromo-2,5-diiodobenzene

C6H2Br2I2CAS 63262-06-6487.70 g/mol

Open in Covalent MOL file
IBrIBr
Aryl halide

Properties

Molecular formula
C6H2Br2I2
Molar mass
487.70 g/mol
Exact mass
485.6613 Da
logP
4.42Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
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
63262-06-6
SMILES
C1=C(C(=CC(=C1I)Br)I)Br
InChIKey
IVKPEQAIHJWGGT-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Br2I2/c7-3-1-5(9)4(8)2-6(3)10/h1-2H

Weigh it out

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Work with 1,4-Dibromo-2,5-diiodobenzene

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

1-Bromo-4-chloro-2-iodobenzene148836-41-350 % similar 1-Bromo-4-fluoro-2-iodobenzene202865-72-350 % similar 2-Bromo-4-fluoro-1-iodobenzene202865-73-450 % similar 2-Bromo-4-chloro-1-iodobenzene31928-44-650 % similar 1-Bromo-2-iodobenzene583-55-150 % similar 3-Bromo-4-iodotoluene71838-16-950 % similar 2-Bromo-1-iodo-4-methoxybenzene466639-53-244 % similar 1-Bromo-2-iodo-4-(trifluoromethyl)benzene640280-28-044 % similar

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

Elsewhere

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