5-Nitro-2-phenoxyaniline
Basic information
- CAS
5410-98-0- Standard SMILES
Nc1cc([N+](=O)[O-])ccc1Oc1ccccc1- InChIKey
JLDQORDBQQXPCI-UHFFFAOYSA-N- Molecular formula
- C12H10N2O3
- Average molar mass
- 230.22 g/mol
- Monoisotopic mass
- 230.06914219
Names & identifiers
- Preferred name
- 5-Nitro-2-phenoxyaniline
- IUPAC
- 5-nitro-2-phenoxyaniline
Names & synonyms
5410-98-05-nitro-2-phenoxyanilineNSC108665-nitro-2-phenoxyphenylamine2-amino-4 -nitrodiphenyl etherDTXSID50278974NSC 10866NSC-10866AKOS011797771
Database identifiers
- CAS
5410-98-0- PubChem CID
- 223328
- DTXSID
DTXSID50278974
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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