| CAS Number | 1083424-17-2 |
| Catalog Number | AG01DUYH |
| Chemical Name | 4-Ethyl-1,2,5-oxadiazole-3-carboxylic Acid |
| IUPAC Name | 4-ethyl-1,2,5-oxadiazole-3-carboxylic acid |
| InChI | InChI=1S/C5H6N2O3/c1-2-3-4(5(8)9)7-10-6-3/h2H2,1H3,(H,8,9) |
| InChI Key | WRSLBEBHVLDFNB-UHFFFAOYSA-N |
| MDL Number | MFCD26937737 |
| Molecular Formula | C5H6N2O3 |
| Molecular Weight | 142.1127 |
| SMILES | C(C)C=1C(=NON1)C(=O)O |
| Synonyms | 4-Ethyl-1,2,5-oxadiazole-3-carboxylic acid,
1083424-17-2,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.114g/mol |
| Monoisotopic Mass | 142.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 76.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number