Basic information
- CAS
102072-74-2- Standard SMILES
O=C1C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])nc2C([O-])=C1[N+](=O)[O-].[Na+]- InChIKey
ZNTOMXNSGATNTR-UHFFFAOYSA-M- Molecular formula
- C15H6N3NaO7
- Average molar mass
- 363.21 g/mol
- Monoisotopic mass
- 363.01034382
Names & identifiers
- Preferred name
- 6-Hydroxy-7-nitro-2-(2-nitrophenyl)-5,8-quinolinedione sodium salt
- IUPAC
- sodium 7-nitro-2-(2-nitrophenyl)-5,6-dioxoquinolin-8-olate
Names & synonyms
102072-74-26-Hydroxy-7-nitro-2-(2-nitrophenyl)-5,8-quinolinedione sodium salt5,8-Quinolinedione, 6-hydroxy-7-nitro-2-(2-nitrophenyl)-, sodium salt
Database identifiers
- CAS
102072-74-2- PubChem CID
- 149153
Properties
Computed structural properties
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 1
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 663
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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