| CAS Number | 1780694-01-0 |
| Catalog Number | AG01BI76 |
| Chemical Name | [2-(trifluoromethyl)-1,3-oxazol-4-yl]methanamine |
| IUPAC Name | [2-(trifluoromethyl)-1,3-oxazol-4-yl]methanamine |
| InChI | InChI=1S/C5H5F3N2O/c6-5(7,8)4-10-3(1-9)2-11-4/h2H,1,9H2 |
| InChI Key | NCDGBPNIPDNTIN-UHFFFAOYSA-N |
| MDL Number | MFCD28517722 |
| Molecular Formula | C5H5F3N2O |
| Molecular Weight | 166.1012 |
| SMILES | NCC1N=C(C(F)(F)F)OC=1 |
| Synonyms | AKOS024053331,
[2-(trifluoromethyl)-1,3-oxazol-4-yl]methanamine,
1780694-01-0,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.103g/mol |
| Monoisotopic Mass | 166.035g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number