| CAS Number | 28917-17-1 |
| Catalog Number | AG01AH5L(AGN-PC-0WBNVR) |
| Chemical Name | 5-Ethenyl-3-phenyl-1,2,4-oxadiazole |
| IUPAC Name | 5-ethenyl-3-phenyl-1,2,4-oxadiazole |
| InChI | InChI=1S/C10H8N2O/c1-2-9-11-10(12-13-9)8-6-4-3-5-7-8/h2-7H,1H2 |
| InChI Key | WSTDQQDNFXEASU-UHFFFAOYSA-N |
| MDL Number | MFCD18785457 |
| Molecular Formula | C10H8N2O |
| Molecular Weight | 172.1833 |
| SMILES | C(=C)C1=NC(=NO1)C1=CC=CC=C1 |
| Synonyms | 5-ethenyl-3-phenyl-1,2,4-oxadiazole,
28917-17-1,
3-Phenyl-5-vinyl-1,2,4-oxadiazole,
ZINC62151961,
AKOS008154267,
MCULE-5384915032,
NE30766,
EN300-73774,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.187g/mol |
| Monoisotopic Mass | 172.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number