Basic information
- CAS
19062-91-0- Standard SMILES
Brc1ccc(C2=Nc3ccccc3C=CO2)cc1- InChIKey
XDQYDLMZRODXFR-UHFFFAOYSA-N- Molecular formula
- C15H10BrNO
- Average molar mass
- 300.15 g/mol
- Monoisotopic mass
- 298.99458
Names & identifiers
- Preferred name
- 2-(4-Bromophenyl)-3,1-benzoxazepine
- IUPAC
- 2-(4-bromophenyl)-3,1-benzoxazepine
- English name
- 2-(p-Bromophenyl)-3,1-benzoxazepine
- Molecular formula
- C15H10BrNO
- Molecular weight
- 0
Names & synonyms
2-(4-Bromophenyl)-3,1-benzoxazepine19062-91-0DTXSID40347582RefChem:252011DTXCID702986542-(p-Bromophenyl)-3,1-benzoxazepine3,1-Benzoxazepine, 2-(p-bromophenyl)-XDQYDLMZRODXFR-UHFFFAOYSA-N2-(4-Bromophenyl)-3,1-benzoxazepine #2-(4-bromo-phenyl)-benzo[d][1,3]oxazepine
Database identifiers
- CAS
19062-91-0- PubChem CID
- 623259
- DTXSID
DTXSID40347582- Nikkaji
- J146.754I
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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