N-(2-Fluoro-5-(trifluoromethyl)phenyl)pyrazine-2-carboxamide
Basic information
- CAS
606132-13-2- Standard SMILES
O=C(Nc1cc(C(F)(F)F)ccc1F)c1cnccn1- InChIKey
ISXDYNXDDJZWOI-UHFFFAOYSA-N- Molecular formula
- C12H7F4N3O
- Average molar mass
- 285.2 g/mol
Names & identifiers
- Preferred name
- N-(2-Fluoro-5-(trifluoromethyl)phenyl)pyrazine-2-carboxamide
- IUPAC
- N-[2-fluoro-5-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
- English name
- Pyrazinecarboxamide, N-[2-fluoro-5-(trifluoromethyl)phenyl]- (9CI)
- Molecular formula
- C12H7F4N3O
- Molecular weight
- 285.2
Names & synonyms
606132-13-2N-(2-Fluoro-5-(trifluoromethyl)phenyl)pyrazine-2-carboxamideN-[2-Fluoro-5-(trifluoromethyl)phenyl]-2-pyrazinecarboxamideSR-01000329584SR-01000329584-12-Pyrazinecarboxamide, N-[2-fluoro-5-(trifluoromethyl)phenyl]-Pyrazinecarboxamide, N-[2-fluoro-5-(trifluoromethyl)phenyl]- (9CI)
Database identifiers
- CAS
606132-13-2
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 350
Physicochemical properties
- Boiling point
- 264.5 · 264.5±40.0 °C(Predicted)
- Density
- 1.481 · 1.481±0.06 g/cm3(Predicted)
- pka
- 10.28 · 10.28±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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