4,5-Dibromopyridazin-3-one

C₄H₂Br₂N₂OCAS 5788-58-9253.88 g/mol

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Properties

Molecular formula: C₄H₂Br₂N₂O
Molar mass: 253.88 g/mol
Exact mass: 251.8534 Da
logP: 1.29Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 2
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

5788-58-9

SMILES

C1=NNC(=O)C(=C1Br)Br

InChIKey

AGLQURQNVJVJNB-UHFFFAOYSA-N

InChI

InChI=1S/C4H2Br2N2O/c5-2-1-7-8-4(9)3(2)6/h1H,(H,8,9)

Weigh it out

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Names and synonyms

1 names

4,5-Dibromo-2,3-dihydropyridazin-3-one

Work with 4,5-Dibromopyridazin-3-one

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

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

Elsewhere

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