| CAS Number | 98519-66-5 |
| Catalog Number | AG01DWXS(AGN-PC-0OOWVW) |
| Chemical Name | 4-Bromo-2,6-dichloropyrimidine |
| IUPAC Name | 4-bromo-2,6-dichloropyrimidine |
| InChI | InChI=1S/C4HBrCl2N2/c5-2-1-3(6)9-4(7)8-2/h1H |
| InChI Key | DQKJOXAJZKPHOH-UHFFFAOYSA-N |
| MDL Number | MFCD22044807 |
| Molecular Formula | C4HBrCl2N2 |
| Molecular Weight | 227.8741 |
| SMILES | ClC1=CC(Br)=NC(Cl)=N1 |
| Synonyms | 4-bromo-2,6-dichloropyrimidine,
98519-66-5,
6-Bromo-2,4-dichloropyrimidine,
SCHEMBL18381558,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.87g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.87g/mol |
| Monoisotopic Mass | 225.87g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
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