Basic information
- CAS
923288-68-0- Standard SMILES
CON(C)C(=O)c1cccnc1C(F)(F)F- InChIKey
VQXXLJKLJNCNPR-UHFFFAOYSA-N- Molecular formula
- C9H9F3N2O2
- Average molar mass
- 234.17 g/mol
- Monoisotopic mass
- 234.06161219
Names & identifiers
- Preferred name
- N-Methoxy-N-methyl-2-(trifluoromethyl)nicotinamide
- IUPAC
- N-methoxy-N-methyl-2-(trifluoromethyl)pyridine-3-carboxamide
- English name
- 3-Pyridinecarboxamide, N-methoxy-N-methyl-2-(trifluoromethyl)-
- Molecular formula
- C9H9F3N2O2
- Molecular weight
- 234.18
Names & synonyms
N-Methoxy-N-methyl-2-(trifluoromethyl)nicotinamide923288-68-0SCHEMBL1447353DTXSID80854306N-Methoxy-N-methyl-2-(trifluoromethyl)pyridine-3-carboxamideMFCD18256685N-methoxy-N-methyl-2-trifluoromethyl-nicotinamideN-Methoxy-N-methyl-2-(trifluoromethyl)-3-pyridinecarboxamide3-Pyridinecarboxamide, N-methoxy-N-methyl-2-(trifluoromethyl)-
Database identifiers
- CAS
923288-68-0- PubChem CID
- 71445792
- DTXSID
DTXSID80854306
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Boiling point
- 323.8 · 323.8±42.0 °C(Predicted)
- Density
- 1.316 · 1.316±0.06 g/cm3(Predicted)
- pka
- -1.52 · -1.52±0.22(Predicted)
Chemistry & industry
Suppliers2 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
5 records
Compound notes
Loading…