Fluoranthene, 1,8-dinitro
Basic information
- CAS
105735-72-6- Standard SMILES
O=[N+]([O-])c1ccc2c(c1)-c1cccc3ccc([N+](=O)[O-])c-2c13- InChIKey
XURGYFQGKWPRJW-UHFFFAOYSA-N- Molecular formula
- C16H8N2O4
- Average molar mass
- 292.24 g/mol
- Monoisotopic mass
- 292.04840674
Names & identifiers
- Preferred name
- Fluoranthene, 1,8-dinitro
- IUPAC
- 1,8-dinitrofluoranthene
Names & synonyms
Fluoranthene, 1,8-dinitroFluoranthene, 1,8-dinitro-105735-72-61,8-dinitrofluorantheneDTXSID80909704XURGYFQGKWPRJW-UHFFFAOYSA-N
Database identifiers
- CAS
105735-72-6- PubChem CID
- 184572
- DTXSID
DTXSID80909704
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 486
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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