Basic information
- CAS
24127-30-8- Standard SMILES
CCOC1Nc2ccc(Br)cc2-c2ccccc2C1=O- InChIKey
LHBGIJMFYCHLPW-UHFFFAOYSA-N- Molecular formula
- C16H14BrNO2
- Average molar mass
- 332.19 g/mol
- Monoisotopic mass
- 331.02079
Names & identifiers
- Preferred name
- 2-Bromo-6-ethoxy-5,6-dihydro-7h-dibenzo[b,d]azepin-7-one
- IUPAC
- 2-bromo-6-ethoxy-5,6-dihydrobenzo[d][1]benzazepin-7-one
Names & synonyms
24127-30-82-bromo-6-ethoxy-5,6-dihydro-7h-dibenzo[b,d]azepin-7-oneNSC137455DTXSID50300522NSC-137455
Database identifiers
- CAS
24127-30-8- PubChem CID
- 283145
- DTXSID
DTXSID50300522
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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