Basic information
- Standard SMILES
CC(C)(C)OC(=O)CCC(NC(=O)c1ccc([N+](=O)[O-])cc1F)C(=O)OC(C)(C)C- InChIKey
PDZMTDIMWUNFMN-UHFFFAOYSA-N- Molecular formula
- C20H27FN2O7
- Average molar mass
- 426.4 g/mol
Names & identifiers
- Preferred name
- Ditert-butyl 2-[(2-fluoro-4-nitrobenzoyl)amino]pentanedioate
- IUPAC
- ditert-butyl 2-[(2-fluoro-4-nitrobenzoyl)amino]pentanedioate
Database identifiers
- PubChem CID
- 21765686
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 649
Related reactions
1 records
Compound notes
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