2-(bis(4-bromobenzyl)amino)-9H-fluoren-9-one
Basic information
- CAS
96176-12-4- Standard SMILES
O=C1c2ccccc2-c2ccc(N(Cc3ccc(Br)cc3)Cc3ccc(Br)cc3)cc21- InChIKey
ISUTUHVJGVOEHQ-UHFFFAOYSA-N- Molecular formula
- C27H19Br2NO
- Average molar mass
- 533.3 g/mol
- Monoisotopic mass
- 530.98334
Names & identifiers
- Preferred name
- 2-(bis(4-bromobenzyl)amino)-9H-fluoren-9-one
- IUPAC
- 2-[bis[(4-bromophenyl)methyl]amino]fluoren-9-one
Names & synonyms
NSC184512-(bis(4-bromobenzyl)amino)-9H-fluoren-9-one96176-12-4NSC-18451Fluoren-9-one, 2-[bis(p-bromobenzyl)amino]-NCIStruc1_000363NCIStruc2_001090CHEMBL1476952DTXSID80280742NCI18451CCG-37490NCGC00013241
Show more names
NCGC00013241-02NCGC00096360-01NCI60_0015362-{Bis[(4-bromophenyl)methyl]amino}-9H-fluoren-9-one
Database identifiers
- CAS
96176-12-4- PubChem CID
- 227150
- DTXSID
DTXSID80280742- ChEMBL
CHEMBL1476952
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 586
Related reactions
0 records
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Compound notes
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