Basic information
- Standard SMILES
Br.Nc1cccc(C(=O)CBr)c1- InChIKey
PGBARHRJKVWGFH-UHFFFAOYSA-N- Molecular formula
- C8H9Br2NO
- Average molar mass
- 294.97 g/mol
- Monoisotopic mass
- 292.90509
Names & identifiers
- Preferred name
- 3-Amino-phenacyl bromide hydrobromide
- IUPAC
- 1-(3-aminophenyl)-2-bromoethanone;hydrobromide
Names & synonyms
15473-81-11-(3-Aminophenyl)-2-bromoethan-1-one hydrobromideSCHEMBL556148PGBARHRJKVWGFH-UHFFFAOYSA-N3-amino-phenacyl bromide hydrobromideSY3149943 inverted exclamation mark -Amino-2-bromoacetophenone Hydrobromide
Database identifiers
- PubChem CID
- 20165104
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 149
Related reactions
1 records
Compound notes
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