Basic information
- CAS
1059189-75-1- Standard SMILES
COc1cccc2c(OC)c([N+](=O)[O-])ccc12- InChIKey
ZZWSLGCRSYGROV-UHFFFAOYSA-N- Molecular formula
- C12H11NO4
- Average molar mass
- 233.22 g/mol
- Monoisotopic mass
- 233.06880783
Names & identifiers
- Preferred name
- 1,5-Dimethoxy-2-nitronaphthalene
- IUPAC
- 1,5-dimethoxy-2-nitronaphthalene
Names & synonyms
1,5-Dimethoxy-2-nitronaphthaleneDTXSID5013018641059189-75-1
Database identifiers
- CAS
1059189-75-1- PubChem CID
- 102408718
- DTXSID
DTXSID501301864- Nikkaji
- J2.615.042F
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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