Basic information
- Standard SMILES
COCC(=O)Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1- InChIKey
VYPHULFEJARTLN-UHFFFAOYSA-N- Molecular formula
- C10H9F3N2O4
- Average molar mass
- 278.18 g/mol
- Monoisotopic mass
- 278.05144126
Names & identifiers
- Preferred name
- 2-methoxy-N-(3-nitro-5-(trifluoromethyl)phenyl)acetamide
- IUPAC
- 2-methoxy-N-[3-nitro-5-(trifluoromethyl)phenyl]acetamide
Names & synonyms
2-methoxy-N-(3-nitro-5-(trifluoromethyl)phenyl)acetamideSCHEMBL15541859
Database identifiers
- PubChem CID
- 90020182
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 343
Related reactions
2 records
Compound notes
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