Basic information
- Standard SMILES
NCCCOc1ccc(F)cc1[N+](=O)[O-]- InChIKey
VBJLGPCAUXHTQG-UHFFFAOYSA-N- Molecular formula
- C9H11FN2O3
- Average molar mass
- 214.19 g/mol
- Monoisotopic mass
- 214.07537038
Names & identifiers
- Preferred name
- 3-(4-Fluoro-2-nitrophenoxy)propylamine
- IUPAC
- 3-(4-fluoro-2-nitrophenoxy)propan-1-amine
Names & synonyms
SCHEMBL1136110VBJLGPCAUXHTQG-UHFFFAOYSA-NAKOS0116334673-(4-fluoro-2-nitrophenoxy)propylamine
Database identifiers
- PubChem CID
- 62348405
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Related reactions
20 records
Compound notes
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