5-bromo-2-(4-chlorophenyl)-1H-isoindole-1,3(2H)-dione
Basic information
- CAS
82104-73-2- Standard SMILES
O=C1c2ccc(Br)cc2C(=O)N1c1ccc(Cl)cc1- InChIKey
RFQYZIXJSBVCGJ-UHFFFAOYSA-N- Molecular formula
- C14H7BrClNO2
- Average molar mass
- 336.57 g/mol
- Monoisotopic mass
- 334.93487
Names & identifiers
- Preferred name
- 5-bromo-2-(4-chlorophenyl)-1H-isoindole-1,3(2H)-dione
- IUPAC
- 5-bromo-2-(4-chlorophenyl)isoindole-1,3-dione
Names & synonyms
82104-73-25-bromo-2-(4-chlorophenyl)-1H-isoindole-1,3(2H)-dione5-Bromo-2-(4-chlorophenyl)isoindoline-1,3-dioneAG-205/331460215-bromo-2-(4-chlorophenyl)-2,3-dihydro-1H-isoindole-1,3-dione5-bromo-2-(4-chlorophenyl)isoindole-1,3-dioneDTXSID40354074STK289898AKOS000734911EU-0067116SR-01000391573SR-01000391573-1
Database identifiers
- CAS
82104-73-2- PubChem CID
- 762858
- DTXSID
DTXSID40354074
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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