4,7-Dibromo-2,1,3-benzoxadiazole

C6H2Br2N2OCAS 54286-63-4277.90 g/mol

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BrBrNON
Aryl halide

Properties

Molecular formula
C6H2Br2N2O
Molar mass
277.90 g/mol
Exact mass
275.8534 Da
logP
2.75Crippen estimate
Polar surface area
38.9 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
54286-63-4
SMILES
Brc1ccc(Br)c2nonc12
InChIKey
ZUGAIWASFADONS-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Br2N2O/c7-3-1-2-4(8)6-5(3)9-11-10-6/h1-2H

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Names and synonyms

4 names
  • 2,1,3-Benzoxadiazole, 4,7-dibromo-
  • Benzofurazan, 4,7-dibromo-
  • 4,7-Dibromobenzofurazan
  • 4,7-Dibromobenzo[c][1,2,5]oxadiazole

Work with 4,7-Dibromo-2,1,3-benzoxadiazole

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

4,7-Dibromo-2,1,3-benzothiadiazole15155-41-648 % similar 4-Bromo-1H-benzimidazole83741-35-938 % similar 8-Bromoquinoline16567-18-336 % similar 5-Bromo-2,1,3-benzoxadiazole51376-06-836 % similar 1,2-Dibromobenzene583-53-935 % similar 1,4-Dibromo-2,3-difluorobenzene156682-52-935 % similar 2,1,3-Benzoxadiazole273-09-635 % similar 3,6-Dibromo-1,2-benzenediamine69272-50-035 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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