Basic information
- Standard SMILES
CC(C)(C)OC(=O)Cc1ccc([N+](=O)[O-])cc1F- InChIKey
GQJRIUFRAGQVNM-UHFFFAOYSA-N- Molecular formula
- C12H14FNO4
- Average molar mass
- 255.24 g/mol
Names & identifiers
- Preferred name
- tert-Butyl 2-(2-fluoro-4-nitrophenyl)acetate
- IUPAC
- tert-butyl 2-(2-fluoro-4-nitrophenyl)acetate
Names & synonyms
tert-Butyl 2-(2-fluoro-4-nitrophenyl)acetate543683-33-6SCHEMBL6609945GQJRIUFRAGQVNM-UHFFFAOYSA-Nt-butyl 2-fluoro-4-nitrophenylacetatetert-Butyl2-(2-fluoro-4-nitrophenyl)acetate
Database identifiers
- PubChem CID
- 69838291
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Related reactions
2 records
Compound notes
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