5-Bromo-2,4-dichloropyrimidine

C₄HBrCl₂N₂CAS 36082-50-5227.87 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄HBrCl₂N₂
Molar mass: 227.87 g/mol
Exact mass: 225.8700 Da
Boiling point: 112–113 °C (at 12 Torr)
logP: 2.55Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

36082-50-5

SMILES

Clc1ncc(Br)c(Cl)n1

InChIKey

SIKXIUWKPGWBBF-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

5 names

Pyrimidine, 5-bromo-2,4-dichloro-
5-Bromo-2,6-dichloropyrimidine
2,4-Dichloro-5-bromopyrimidine
NSC 152517
2,6-Dichloro-5-bromopyrimidine

Work with 5-Bromo-2,4-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

5-Bromo-4-chloropyrimidin-2-amine1044767-99-861 % similar 2,4-Dichloro-5-iodopyrimidine13544-44-050 % similar 2,4-Dichloro-5-methylpyrimidine1780-31-050 % similar 2,4-Dichloro-5-fluoropyrimidine2927-71-150 % similar 5-Bromo-4-chloropyrimidine56181-39-650 % similar 8-Bromo-2-chloroquinazoline956100-63-348 % similar 2,4-Dichloro-5-(trifluoromethyl)pyrimidine3932-97-645 % similar 4-Bromo-1-chloroisoquinoline66728-98-145 % similar

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

Same formula

4-Bromo-3,6-dichloropyridazine10344-42-0 5-Bromo-4,6-dichloropyrimidine68797-61-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook