2-phenyl-1H-benzo[f]indole-4,9-dione
Basic information
- CAS
42207-71-6- Standard SMILES
O=C1c2ccccc2C(=O)c2[nH]c(-c3ccccc3)cc21- InChIKey
OISUBBKZGZBYBJ-UHFFFAOYSA-N- Molecular formula
- C18H11NO2
- Average molar mass
- 273.3 g/mol
- Monoisotopic mass
- 273.07897859
Names & identifiers
- Preferred name
- 2-phenyl-1H-benzo[f]indole-4,9-dione
- IUPAC
- 2-phenyl-1H-benzo[f]indole-4,9-dione
Names & synonyms
42207-71-62-phenyl-1H-benzo[f]indole-4,9-dioneNSC240712DTXSID103112502-phenylbenz[f]indole-4,9-dioneNSC-240712
Database identifiers
- CAS
42207-71-6- PubChem CID
- 315469
- DTXSID
DTXSID10311250- Nikkaji
- J2.779.174C
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 440
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Compound notes
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