| CAS Number | 1989659-61-1 |
| Catalog Number | AG01B6OG |
| Chemical Name | methyl 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanoate |
| IUPAC Name | methyl 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanoate |
| InChI | InChI=1S/C9H12N2O3/c1-13-8(12)5-4-7-10-11-9(14-7)6-2-3-6/h6H,2-5H2,1H3 |
| InChI Key | ADZAPAIVCYVUSF-UHFFFAOYSA-N |
| MDL Number | MFCD30342895 |
| Molecular Formula | C9H12N2O3 |
| Molecular Weight | 196.2032 |
| SMILES | COC(CCC1OC(C2CC2)=NN=1)=O |
| Synonyms | methyl 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)propanoate,
1989659-61-1,
ZINC521399238,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.084792g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.2g/mol |
| Monoisotopic Mass | 196.084792g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 65.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number