| CAS Number | 91994-60-4 |
| Catalog Number | AG00IGZ3(AGN-PC-0NG6DA) |
| Chemical Name | 2,2,2-trifluoro-N-(2-hydroxy-2-phenylethyl)acetamide |
| IUPAC Name | 2,2,2-trifluoro-N-(2-hydroxy-2-phenylethyl)acetamide |
| InChI | InChI=1S/C10H10F3NO2/c11-10(12,13)9(16)14-6-8(15)7-4-2-1-3-5-7/h1-5,8,15H,6H2,(H,14,16) |
| InChI Key | FZQBDQGADVTUDJ-UHFFFAOYSA-N |
| MDL Number | MFCD00452118 |
| Molecular Formula | C10H10F3NO2 |
| Molecular Weight | 233.1871 |
| SMILES | OC(c1ccccc1)CNC(=O)C(F)(F)F |
| Synonyms | 2,2,2-trifluoro-N-(2-hydroxy-2-phenylethyl)acetamide,
91994-60-4,
AKOS010227017,
N-(2-Phenyl-2-hydroxyethyl)-2,2,2-trifluoroacetamide,
2,2,2-trifluoro-N-(2-hydroxy-2-phenyl-ethyl)-acetamide,
Acetamide, 2,2,2-trifluoro-N-(2-hydroxy-2-phenylethyl)-,
CID11117946,
2,2,2-trifluoro-N-(2-hydroxy-2-phenyl-ethyl)acetamide,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.19g/mol |
| Monoisotopic Mass | 233.066g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number