| CAS Number | 1803583-98-3 |
| Catalog Number | AG01AIVO |
| Chemical Name | [2-(trifluoromethyl)-1,3-oxazol-5-yl]methanol |
| IUPAC Name | [2-(trifluoromethyl)-1,3-oxazol-5-yl]methanol |
| InChI | InChI=1S/C5H4F3NO2/c6-5(7,8)4-9-1-3(2-10)11-4/h1,10H,2H2 |
| InChI Key | QZRLHBNUDXHETP-UHFFFAOYSA-N |
| MDL Number | MFCD28348354 |
| Molecular Formula | C5H4F3NO2 |
| Molecular Weight | 167.0860 |
| SMILES | OCC1OC(C(F)(F)F)=NC=1 |
| Synonyms | [2-(trifluoromethyl)-1,3-oxazol-5-yl]methanol,
1803583-98-3,
ZINC238855253,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.087g/mol |
| Monoisotopic Mass | 167.019g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number