| CAS Number | 1153456-93-9 |
| Catalog Number | AG01A9DH(AGN-PC-0WO69E) |
| Chemical Name | [5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanol |
| IUPAC Name | [5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanol |
| InChI | InChI=1S/C9H7FN2O2/c10-7-3-1-6(2-4-7)9-11-8(5-13)12-14-9/h1-4,13H,5H2 |
| InChI Key | USFDLNBWFJBASE-UHFFFAOYSA-N |
| MDL Number | MFCD09027668 |
| Molecular Formula | C9H7FN2O2 |
| Molecular Weight | 194.1625 |
| SMILES | OCC1N=C(C2=CC=C(F)C=C2)ON=1 |
| Synonyms | [5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanol,
1153456-93-9,
AC1Q7C5G,
ZINC36757588,
AKOS008135357,
MCULE-7173282148,
NE27597,
EN300-64782,
(5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl)methanol,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.165g/mol |
| Monoisotopic Mass | 194.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 59.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number