| CAS Number | 2089649-91-0 |
| Catalog Number | AG01JHJT |
| Chemical Name | Ethyl 2-(5-(Aminomethyl)-1,2,4-Oxadiazol-3-Yl)Acetate Hydrochloride |
| IUPAC Name | ethyl 2-[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]acetate;hydrochloride |
| InChI | InChI=1S/C7H11N3O3.ClH/c1-2-12-7(11)3-5-9-6(4-8)13-10-5;/h2-4,8H2,1H3;1H |
| InChI Key | JFYWZHJXBHDNKF-UHFFFAOYSA-N |
| MDL Number | MFCD30828790 |
| Molecular Formula | C7H12ClN3O3 |
| Molecular Weight | 221.6415 |
| SMILES | Cl.NCC1=NC(=NO1)CC(=O)OCC |
| Synonyms | Ethyl 2-(5-(aminomethyl)-1,2,4-oxadiazol-3-yl)acetate hydrochloride,
2089649-91-0,
CS-16024,
CS-0084307,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.056719g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.64g/mol |
| Monoisotopic Mass | 221.056719g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 91.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number