4-Bromo-1-methylpyridin-2(1H)-one

C₆H₆BrNOCAS 214342-63-9188.02 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₆BrNO
Molar mass: 188.02 g/mol
Exact mass: 186.9633 Da
logP: 1.15Crippen estimate
Polar surface area: 22.0 Å²
H-bond donors / acceptors: 0 / 1
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

214342-63-9

SMILES

CN1C=CC(=CC1=O)Br

InChIKey

YFOQSLIPUHGGQE-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrNO/c1-8-3-2-5(7)4-6(8)9/h2-4H,1H3

Weigh it out

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

Work with 4-Bromo-1-methylpyridin-2(1H)-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

5-Bromo-1-methyl-1H-indole10075-52-248 % similar 1-Methyl-2(1H)-pyridinone694-85-947 % similar 1,3-Dimethyluracil874-14-642 % similar 3,5-Dibromo-1-methylpyridin-2(1H)-one14529-54-540 % similar 5-Bromo-1-methyl-1H-1,3-benzodiazole53484-15-438 % similar 5-Bromopyrazolo[1,5-A]pyridine1060812-84-134 % similar 7-Bromoimidazo(1,2-a)pyridine808744-34-533 % similar 7-Bromo-(1,2,4)triazolo(1,5-a)pyridine1053655-66-532 % similar

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

Same formula

3-Amino-4-bromophenol100367-37-1 4-Bromo-2-methoxypyridine100367-39-3 2-Bromo-5-methoxypyridine105170-27-2 2-Amino-3-bromophenol116435-77-9 (2-Bromopyridin-4-yl)methanol118289-16-0 (6-Bromo-pyridin-3-yl)-methanol122306-01-8 4-Bromo-2-pyridinemethanol131747-45-0 3-Bromo-2-methoxypyridine13472-59-8

Elsewhere

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