| CAS Number | 1248955-29-4 |
| Catalog Number | AG01BGTB |
| Chemical Name | 4-(2-Fluorophenyl)-1,2-oxazol-5-amine |
| IUPAC Name | 4-(2-fluorophenyl)-1,2-oxazol-5-amine |
| InChI | InChI=1S/C9H7FN2O/c10-8-4-2-1-3-6(8)7-5-12-13-9(7)11/h1-5H,11H2 |
| InChI Key | DTKRBINQDFJFMP-UHFFFAOYSA-N |
| MDL Number | MFCD14690896 |
| Molecular Formula | C9H7FN2O |
| Molecular Weight | 178.1631 |
| SMILES | NC1=C(C2=C(F)C=CC=C2)C=NO1 |
| Synonyms | 4-(2-fluorophenyl)-1,2-oxazol-5-amine,
1248955-29-4,
SCHEMBL17532591,
4-(2-fluorophenyl)isoxazol-5-amine,
HTS009203,
ZINC49671934,
AKOS010815585,
Z1945700192,
C9H7FN2O,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.166g/mol |
| Monoisotopic Mass | 178.054g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number