2-Nitro-4-(2-nitrophenoxy)aniline
Basic information
- CAS
393163-27-4- Standard SMILES
Nc1ccc(Oc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
KBIAYUBJOPWTRM-UHFFFAOYSA-N- Molecular formula
- C12H9N3O5
- Average molar mass
- 275.22 g/mol
- Monoisotopic mass
- 275.0542204
Names & identifiers
- Preferred name
- 2-Nitro-4-(2-nitrophenoxy)aniline
- IUPAC
- 2-nitro-4-(2-nitrophenoxy)aniline
Names & synonyms
2-Nitro-4-(2-nitrophenoxy)aniline393163-27-4DTXSID30573116
Database identifiers
- CAS
393163-27-4- PubChem CID
- 15475486
- DTXSID
DTXSID30573116
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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