Basic information
- CAS
47271-56-7- Standard SMILES
O=C1c2ccc([N+](=O)[O-])cc2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]- InChIKey
JMJOTFMLQNWDEW-UHFFFAOYSA-N- Molecular formula
- C13H5N3O7
- Average molar mass
- 315.19 g/mol
- Monoisotopic mass
- 315.01274951
Names & identifiers
- Preferred name
- 2,4,6-Trinitrofluoren-9-one
- IUPAC
- 2,4,6-trinitrofluoren-9-one
Names & synonyms
2,4,6-trinitrofluoren-9-one47271-56-7DTXSID50395993RefChem:245859DTXCID803468522,4,6-trinitro-9H-fluoren-9-one2,4,6-trinitro-9-fluorenoneSCHEMBL6924564STK377548AKOS005449162ST51058867
Database identifiers
- CAS
47271-56-7- PubChem CID
- 3756567
- DTXSID
DTXSID50395993- Nikkaji
- J3.535.977J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 563
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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