Basic information
- CAS
1875-63-4- Standard SMILES
O=[N+]([O-])c1cc2ccccc2cc1[N+](=O)[O-]- InChIKey
IBKNJPIEUANCFH-UHFFFAOYSA-N- Molecular formula
- C10H6N2O4
- Average molar mass
- 218.17 g/mol
- Monoisotopic mass
- 218.03275668
Overview
2,3-dinitronaphthalene is a dinitronaphthalene.
Names & identifiers
- Preferred name
- 2,3-Dinitronaphthalene
- IUPAC
- 2,3-dinitronaphthalene
- English name
- 2,3-Dinitronaphthalene
- Molecular formula
- C10H6N2O4
- Molecular weight
- 218.17
Names & synonyms
2,3-DinitronaphthaleneNAPHTHALENE, 2,3-DINITRO-CHEBI:50644DTXSID30172062RefChem:81871DTXCID7094553IBKNJPIEUANCFH-UHFFFAOYSA-N1875-63-4SCHEMBL4304674SCHEMBL11203665SCHEMBL31549326Q27122166
Database identifiers
- CAS
1875-63-4- PubChem CID
- 74646
- DTXSID
DTXSID30172062- ChEBI
CHEBI:50644- Nikkaji
- J119.291D
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 266
Physicochemical properties
- Melting point
- 170.5 · 170.5-171 °C
- Boiling point
- 427.4 · 427.4±18.0 °C(Predicted)
- Density
- 1.481 · 1.481±0.06 g/cm3(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: 2,3-dinitronaphthalene is a dinitronaphthalene.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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