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Basic information
- Standard SMILES
O=CN1CCc2ccc(Br)cc2C1- InChIKey
NKIIXSDFCKCERN-UHFFFAOYSA-N- Molecular formula
- C10H10BrNO
- Average molar mass
- 240.1 g/mol
- Monoisotopic mass
- 238.99458
Names & identifiers
- Preferred name
- 7-Bromo-3,4-dihydroisoquinoline-2(1H)-carbaldehyde
- IUPAC
- 7-bromo-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
Names & synonyms
7-Bromo-3,4-dihydroisoquinoline-2(1H)-carbaldehyde1350411-25-4SCHEMBL2593505NKIIXSDFCKCERN-UHFFFAOYSA-N7-bromo-3,4-dihydro-1H-isoquinoline-2-carbaldehyde
Database identifiers
- PubChem CID
- 73554612
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 197
Related reactions
1 records
Compound notes
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