Basic information
- Standard SMILES
CCCOc1cc(F)c([N+](=O)[O-])cc1F- InChIKey
WOEPXUKZDOTUPD-UHFFFAOYSA-N- Molecular formula
- C9H9F2NO3
- Average molar mass
- 217.17 g/mol
- Monoisotopic mass
- 217.05504947
Names & identifiers
- Preferred name
- 1,4-Difluoro-2-nitro-5-propoxybenzene
- IUPAC
- 1,4-difluoro-2-nitro-5-propoxybenzene
Names & synonyms
1,4-difluoro-2-nitro-5-propoxybenzene897732-26-2SCHEMBL3249589WOEPXUKZDOTUPD-UHFFFAOYSA-N1,4-difluoro-2-nitro-5-propoxy-benzene
Database identifiers
- PubChem CID
- 68566355
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 222
Related reactions
2 records
Compound notes
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