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

C₆H₂Br₂N₂OCAS 54286-63-4277.90 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂Br₂N₂O
Molar mass: 277.90 g/mol
Exact mass: 275.8534 Da
logP: 2.75Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

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

Weigh it out

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

Names and synonyms

3 names

2,1,3-Benzoxadiazole, 4,7-dibromo-
Benzofurazan, 4,7-dibromo-
4,7-Dibromobenzofurazan

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

8-Bromoquinoline16567-18-336 % similar 1,2-Dibromobenzene583-53-935 % similar 2,1,3-Benzoxadiazole273-09-635 % similar 1,4-Dibromonaphthalene83-53-435 % similar 7-Bromo-benzo[C][1,2,5]thiadiazole-4-carbaldehyde1071224-34-433 % similar 7-Bromo-1H-indazole53857-58-233 % similar 2,1,3-Benzoxadiazol-4-amine767-63-533 % similar 1,2,4-Tribromobenzene615-54-332 % similar

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

Elsewhere

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