5-Bromo-4,6-dichloropyrimidine

C₄HBrCl₂N₂CAS 68797-61-5227.87 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄HBrCl₂N₂
Molar mass: 227.87 g/mol
Exact mass: 225.8700 Da
Melting point: 75–76 °C
logP: 2.55Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

68797-61-5

SMILES

Clc1ncnc(Cl)c1Br

InChIKey

BKLHHTTZTSYHBV-UHFFFAOYSA-N

InChI

InChI=1S/C4HBrCl2N2/c5-2-3(6)8-1-9-4(2)7/h1H

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Names and synonyms

1 names

Pyrimidine, 5-bromo-4,6-dichloro-

Work with 5-Bromo-4,6-dichloropyrimidine

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

4,5,6-Trichloropyrimidine1780-27-452 % similar 4,6-Dichloro-5-iodopyrimidine1137576-38-548 % similar 4,6-Dichloro-5-fluoropyrimidine213265-83-948 % similar 5-Amino-4,6-dichloropyrimidine5413-85-448 % similar 5-(4-Bromophenyl)-4,6-dichloropyrimidine146533-41-746 % similar 3-Bromo-2-chloro-4-methylpyridine55404-31-446 % similar 5-Bromo-4-chloropyrimidine56181-39-646 % similar 4,6-Dichloro-5-methoxypyrimidine5018-38-242 % similar

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

Same formula

4-Bromo-3,6-dichloropyridazine10344-42-0 5-Bromo-2,4-dichloropyrimidine36082-50-5

Elsewhere

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