2-Fluoro-1-nitro-4-propoxybenzene
Basic information
- CAS
28987-49-7- Standard SMILES
CCCOc1ccc([N+](=O)[O-])c(F)c1- InChIKey
RDRWAMYDJLVUCE-UHFFFAOYSA-N- Molecular formula
- C9H10FNO3
- Average molar mass
- 199.18 g/mol
- Monoisotopic mass
- 199.06447134
Names & identifiers
- Preferred name
- 2-Fluoro-1-nitro-4-propoxybenzene
- IUPAC
- 2-fluoro-1-nitro-4-propoxybenzene
Names & synonyms
2-fluoro-1-nitro-4-propoxybenzene28987-49-72-Fluoro-4-propoxynitrobenzeneSCHEMBL4014456SCHEMBL27920396DTXSID40738330RDRWAMYDJLVUCE-UHFFFAOYSA-NAKOS017452570
Database identifiers
- CAS
28987-49-7- PubChem CID
- 68429751
- DTXSID
DTXSID40738330
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 195
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Related reactions
2 records
Compound notes
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