Basic information
- CAS
5978-44-9- Standard SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1.c1ccc2c(c1)Cc1ccccc1-2- InChIKey
CJJKURWIKCSWDL-UHFFFAOYSA-N- Molecular formula
- C19H13N3O7
- Average molar mass
- 395.3 g/mol
- Monoisotopic mass
- 395.07534976
Names & identifiers
- Preferred name
- Fluorene, monopicrate
- IUPAC
- 9H-fluorene;2,4,6-trinitrophenol
Names & synonyms
5978-44-9Fluorene, monopicrate2,4,6-trinitrophenol- 9h-fluorene(1:1)NSC99835DTXSID80295134NSC-998359H-Fluorene,4,6-trinitrophenol (1:1)2,4,6-Trinitrophenol--9H-fluorene (1/1)
Database identifiers
- CAS
5978-44-9- PubChem CID
- 264658
- DTXSID
DTXSID80295134
Properties
Computed structural properties
- Topological polar surface area
- 158 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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