| CAS Number | 1021245-84-0 |
| Catalog Number | AG019SMS(AGN-PC-0WO3HV) |
| Chemical Name | 3-(2,4-Difluorophenyl)-1,2-oxazol-5-amine |
| IUPAC Name | 3-(2,4-difluorophenyl)-1,2-oxazol-5-amine |
| InChI | InChI=1S/C9H6F2N2O/c10-5-1-2-6(7(11)3-5)8-4-9(12)14-13-8/h1-4H,12H2 |
| InChI Key | IWLVIVKGGLGGEH-UHFFFAOYSA-N |
| MDL Number | MFCD11156311 |
| Molecular Formula | C9H6F2N2O |
| Molecular Weight | 196.1535 |
| SMILES | NC1=CC(C2=CC=C(F)C=C2F)=NO1 |
| Synonyms | 3-(2,4-difluorophenyl)-1,2-oxazol-5-amine,
1021245-84-0,
SCHEMBL2315876,
IWLVIVKGGLGGEH-UHFFFAOYSA-N,
ZINC20078703,
AKOS000261581,
MCULE-3885681260,
NE29500,
3-(2,4-Difluorophenyl)isoxazol-5-amine,
3-(2,4-difluoro-phenyl)-isoxazol-5-ylamine,
EN300-94337,
Z1270446303,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.157g/mol |
| Monoisotopic Mass | 196.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number