5-(4-Bromophenyl)tetraphene-7,12-dione
Basic information
- CAS
62051-45-0- Standard SMILES
O=C1c2ccccc2C(=O)c2c1cc(-c1ccc(Br)cc1)c1ccccc21- InChIKey
RLCDXBZKYYXJSP-UHFFFAOYSA-N- Molecular formula
- C24H13BrO2
- Average molar mass
- 413.3 g/mol
- Monoisotopic mass
- 412.00989
Names & identifiers
- Preferred name
- 5-(4-Bromophenyl)tetraphene-7,12-dione
- IUPAC
- 5-(4-bromophenyl)benzo[a]anthracene-7,12-dione
Names & synonyms
62051-45-05-(4-Bromophenyl)tetraphene-7,12-dioneDTXSID60488148
Database identifiers
- CAS
62051-45-0- PubChem CID
- 12318655
- DTXSID
DTXSID60488148
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 593
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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