Basic information
- Standard SMILES
CCOC(=O)c1cc(Oc2ccccc2)ccc1[N+](=O)[O-]- InChIKey
BRCPXIGXRITTCU-UHFFFAOYSA-N- Molecular formula
- C15H13NO5
- Average molar mass
- 287.27 g/mol
- Monoisotopic mass
- 287.07937252
Names & identifiers
- Preferred name
- Ethyl 2-nitro-5-phenoxybenzoate
- IUPAC
- ethyl 2-nitro-5-phenoxybenzoate
Names & synonyms
SCHEMBL4268650ethyl 2-nitro-5-phenoxybenzoateBRCPXIGXRITTCU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 57796884
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 362
Related reactions
4 records
Compound notes
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