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Basic information
- CAS
845267-58-5- Standard SMILES
Br.Nc1nccc(C(=O)CBr)n1- InChIKey
SDADNLKASSSIDI-UHFFFAOYSA-N- Molecular formula
- C6H7Br2N3O
- Average molar mass
- 296.95 g/mol
- Monoisotopic mass
- 294.89559
Names & identifiers
- Preferred name
- 1-(2-Aminopyrimidin-4-yl)-2-bromoethanone hydrobromide
- IUPAC
- 1-(2-aminopyrimidin-4-yl)-2-bromoethanone;hydrobromide
- English name
- 1-(2-AMinopyriMidin-4-yl)-2-broMoethanone hydrobroMide
- Molecular formula
- C6H7Br2N3O
- Molecular weight
- 296.94728
Names & synonyms
1-(2-aminopyrimidin-4-yl)-2-bromoethanone hydrobromide845267-58-5SCHEMBL4518423DTXSID30712346SDADNLKASSSIDI-UHFFFAOYSA-NAKOS015951431DB-200797F864641-(2-Aminopyrimidin-4-yl)-2-bromoethan-1-one--hydrogen bromide (1/1)
Database identifiers
- CAS
845267-58-5- PubChem CID
- 54579892
- DTXSID
DTXSID30712346
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Chemistry & industry
Suppliers1 total
HBCChem, Inc.+1-510-219-6317 · [email protected]
Related reactions
1 records
Compound notes
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