Compound C9H12BrN3O2
4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one
CAS: 5580-94-9
| Molecular Formula | C9H12BrN3O2 |
|---|---|
| Molecular Weight | 274.11 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 67.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.0113 |
| Heavy Atoms | 15 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 5580-94-9 |
|---|---|
| SMILES | C1CCOC(C1)N2C=C(C(=NC2=O)N)Br |
| InChIKey | VPNCDRSZEJJPSI-UHFFFAOYSA-N |
📖 Product Overview
Compound C9H12BrN3O2 (CAS: 5580-94-9) is a chemical compound with molecular formula C9H12BrN3O2 and molecular weight 274.11 g/mol. Its IUPAC systematic name is 4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one.
VPNCDRSZEJJPSI-UHFFFAOYSA-N.
SMILES: C1CCOC(C1)N2C=C(C(=NC2=O)N)Br.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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📚 Academic Support
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