4-Nitro-1,2-dihydroacenaphthylene
Basic information
- CAS
1015-74-3- Standard SMILES
O=[N+]([O-])c1cc2c3c(cccc3c1)CC2- InChIKey
NPNRZUBMQUTWPW-UHFFFAOYSA-N- Molecular formula
- C12H9NO2
- Average molar mass
- 199.2 g/mol
- Monoisotopic mass
- 199.06332853
Names & identifiers
- Preferred name
- 4-Nitro-1,2-dihydroacenaphthylene
- IUPAC
- 4-nitro-1,2-dihydroacenaphthylene
Names & synonyms
1015-74-34-nitro-1,2-dihydroacenaphthylene4-nitroacenaphtheneNSC204882Acenaphthene, 4-nitro-SCHEMBL5376486DTXSID50308548Acenaphthylene,2-dihydro-4-nitro-WLN: L566 1A LT&&J GNWNSC-204882
Database identifiers
- CAS
1015-74-3- PubChem CID
- 307127
- DTXSID
DTXSID50308548
Properties
Computed structural properties
- XLogP
- 3.3
- 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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