| CAS Number | 2055119-12-3 |
| Catalog Number | AG00I3WN(AGN-PC-0WR48Y) |
| Chemical Name | N-(2-Hydroxyethyl)-5-(trifluoromethyl)pyridine-3-carboxamide |
| IUPAC Name | N-(2-hydroxyethyl)-5-(trifluoromethyl)pyridine-3-carboxamide |
| InChI | InChI=1S/C9H9F3N2O2/c10-9(11,12)7-3-6(4-13-5-7)8(16)14-1-2-15/h3-5,15H,1-2H2,(H,14,16) |
| InChI Key | FMZICCHLMZGIAX-UHFFFAOYSA-N |
| MDL Number | MFCD30527681 |
| Molecular Formula | C9H9F3N2O2 |
| Molecular Weight | 234.1752 |
| SMILES | OCCNC(=O)c1cncc(c1)C(F)(F)F |
| Synonyms | N-(2-Hydroxyethyl)-5-(trifluoromethyl)pyridine-3-carboxamide,
2055119-12-3,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.178g/mol |
| Monoisotopic Mass | 234.062g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 62.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number