Basic information
- Standard SMILES
CCNc1ccc(C=O)cc1Br- InChIKey
XUBRIMJGYHSDAR-UHFFFAOYSA-N- Molecular formula
- C9H10BrNO
- Average molar mass
- 228.09 g/mol
- Monoisotopic mass
- 226.99458
Names & identifiers
- Preferred name
- 3-Bromo-4-ethylamino benzaldehyde
- IUPAC
- 3-bromo-4-(ethylamino)benzaldehyde
Names & synonyms
SCHEMBL57616553-bromo-4-ethylamino benzaldehydeXUBRIMJGYHSDAR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21966475
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Related reactions
2 records
Compound notes
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