2,2,3,3,4,4,4-heptafluoro-N-(2-nitrophenyl)butanamide
Basic information
- CAS
438615-07-7- Standard SMILES
O=C(Nc1ccccc1[N+](=O)[O-])C(F)(F)C(F)(F)C(F)(F)F- InChIKey
QPHWRPQUQFDFFA-UHFFFAOYSA-N- Molecular formula
- C10H5F7N2O3
- Average molar mass
- 334.15 g/mol
- Monoisotopic mass
- 334.01883916
Names & identifiers
- Preferred name
- 2,2,3,3,4,4,4-heptafluoro-N-(2-nitrophenyl)butanamide
- IUPAC
- 2,2,3,3,4,4,4-heptafluoro-N-(2-nitrophenyl)butanamide
Names & synonyms
2,2,3,3,4,4,4-heptafluoro-N-(2-nitrophenyl)butanamideDTXSID001353484N-Heptafluorobutyryl-2-nitroanilineSTK428483AKOS003272280NCGC00336959-01ST50919992AB01330117-02438615-07-7
Database identifiers
- CAS
438615-07-7- PubChem CID
- 4092950
- DTXSID
DTXSID001353484
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 447
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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