A1BDM
Summary
| Name: | 2-bromopyrimidine |
| Formula: | C4 H3 Br N2 |
| Formal charge: | 0 |
| Formula weight: | 158.984 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-bromopyrimidine |
| OpenEye OEToolkits | 3.1.0.0 | 2-bromanylpyrimidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Brc1ncccn1 |
| InChI | InChI | 1.06 | InChI=1S/C4H3BrN2/c5-4-6-2-1-3-7-4/h1-3H |
| InChIKey | InChI | 1.06 | PGFIHORVILKHIA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Brc1ncccn1 |
| SMILES | CACTVS | 3.385 | Brc1ncccn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cnc(nc1)Br |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cnc(nc1)Br |
