| CAS Number | 1368039-53-5 |
| Catalog Number | AG01B7W1 |
| Chemical Name | 5-bromo-N,N,4-trimethylpyrimidin-2-amine |
| IUPAC Name | 5-bromo-N,N,4-trimethylpyrimidin-2-amine |
| InChI | InChI=1S/C7H10BrN3/c1-5-6(8)4-9-7(10-5)11(2)3/h4H,1-3H3 |
| InChI Key | XYVGYROXVVYBGV-UHFFFAOYSA-N |
| MDL Number | MFCD22031316 |
| Molecular Formula | C7H10BrN3 |
| Molecular Weight | 216.0784 |
| SMILES | CN(C1=NC(C)=C(Br)C=N1)C |
| Synonyms | 5-bromo-N,N,4-trimethylpyrimidin-2-amine,
1368039-53-5,
ZINC82320737,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.082g/mol |
| Monoisotopic Mass | 215.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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