Nitroacenaphthene
Basic information
- CAS
56286-55-6- Standard SMILES
O=[N+]([O-])C1Cc2cccc3cccc1c23- InChIKey
AVAGDIXDPQCKCQ-UHFFFAOYSA-N- Molecular formula
- C12H9NO2
- Average molar mass
- 199.2 g/mol
- Monoisotopic mass
- 199.06332853
Names & identifiers
- Preferred name
- Nitroacenaphthene
- IUPAC
- 1-nitro-1,2-dihydroacenaphthylene
- English name
- Nitroacenaphthene
- Molecular weight
- 0
Names & synonyms
Nitroacenaphthene56286-55-61-nitro-1,2-dihydroacenaphthyleneAcenaphthylene, 1,2-dihydronitro-CHEMBL355414SCHEMBL4421503DTXSID00971721DB-255798
Database identifiers
- CAS
56286-55-6- PubChem CID
- 148776
- DTXSID
DTXSID00971721- ChEMBL
CHEMBL355414
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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