2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethanolbromidehydrobromide
2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethanol;bromide;hydrobromide
| Molecular Formula | C14H20Br2N4O |
|---|---|
| Molecular Weight | 420.14 g/mol |
| Topological Polar Surface Area | 75.9 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.99835 |
| Heavy Atoms | 21 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 534-64-5 |
|---|---|
| SMILES | CC1=C(C=CC=[N+]1CC2=CN=C(N=C2N)C)CCO.Br.[Br-] |
| InChIKey | DMVBWVASDWGFNH-UHFFFAOYSA-M |
📖 Product Overview
2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethanolbromidehydrobromide (CAS: 534-64-5) is a chemical compound with molecular formula C14H20Br2N4O and molecular weight 420.14 g/mol. Its IUPAC systematic name is 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethanol;bromide;hydrobromide.
DMVBWVASDWGFNH-UHFFFAOYSA-M.
SMILES: CC1=C(C=CC=[N+]1CC2=CN=C(N=C2N)C)CCO.Br.[Br-].
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