4-Bromo-6-methyl-2H-pyridazin-3-one

C₅H₅BrN₂OCAS 954240-46-1189.01 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅BrN₂O
Molar mass: 189.01 g/mol
Exact mass: 187.9585 Da
logP: 0.84Crippen 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

954240-46-1

SMILES

CC1=NNC(=O)C(=C1)Br

InChIKey

MOHYHLFTBMNVDU-UHFFFAOYSA-N

InChI

InChI=1S/C5H5BrN2O/c1-3-2-4(6)5(9)8-7-3/h2H,1H3,(H,8,9)

Weigh it out

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Names and synonyms

1 names

4-Bromo-6-methylpyridazin-3(2H)-one

Work with 4-Bromo-6-methyl-2H-pyridazin-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

Similar compounds

4-Bromo-6-chloro-2,3-dihydropyridazin-3-one933041-13-556 % similar 3-Bromo-2-hydroxy-5-methylpyridine17282-02-944 % similar 3,5-Dimethylpyrazole67-51-643 % similar 4,5-Dibromopyridazin-3-one5788-58-941 % similar 4-Bromopyridazine-3,6-diol15456-86-739 % similar 6-Chloro-4-methyl-2H-pyridazin-3-one1834-27-139 % similar 3-Bromo-2-hydroxy-6-picoline374633-33-737 % similar 3-Bromo-5-methyl-1H-pyrazole57097-81-136 % similar

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

Same formula

2-Bromo-5-methoxypyrimidine1209459-99-3 5-Bromo-2-methoxypyrimidine14001-66-2 4-Bromo-1-methyl-1H-imidazole-5-carbaldehyde141524-74-5 2-Bromo-5-methoxypyrazine143250-10-6 3-Bromo-6-methoxypyridazine17321-29-8 2-Amino-5-bromo-3-hydroxypyridine39903-01-0 3-Amino-5-bromo-pyridin-2-ol98786-86-8

Elsewhere

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