chempirical

5-(4-Bromophenyl)-4,6-dichloropyrimidine

C10H5BrCl2N2CAS 146533-41-7303.97 g/mol

Open in Covalent MOL file
ClNNClBr
Aryl halide

Properties

Molecular formula
C10H5BrCl2N2
Molar mass
303.97 g/mol
Exact mass
301.9013 Da
logP
4.21Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
146533-41-7
SMILES
Clc1ncnc(Cl)c1-c1ccc(Br)cc1
InChIKey
WEEFLZORZXLIJE-UHFFFAOYSA-N
InChI
InChI=1S/C10H5BrCl2N2/c11-7-3-1-6(2-4-7)8-9(12)14-5-15-10(8)13/h1-5H

Weigh it out

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

Names and synonyms

2 names
  • Pyrimidine, 5-(4-bromophenyl)-4,6-dichloro-
  • 4,6-Dichloro-5-(4-bromophenyl)pyrimidine

Work with 5-(4-Bromophenyl)-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

5-Bromo-4,6-dichloropyrimidine68797-61-546 % similar 4,4′-Dibromobiphenyl92-86-444 % similar 4-(4-Bromophenyl)pyridine39795-60-340 % similar 1-Bromo-4-chlorobenzene106-39-839 % similar 4,5,6-Trichloropyrimidine1780-27-439 % similar 4-Bromobiphenyl92-66-038 % similar 1,4-Dibromobenzene106-37-638 % similar 9-(4-Bromophenyl)-10-(naphthalen-1-yl)anthracene1160506-32-037 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook