| CAS Number | 1361116-15-5 |
| Catalog Number | AG00J24T(AGN-PC-0WC8NK) |
| Chemical Name | 3-(aminomethyl)-1,2,4-oxadiazole-5-carboxamide hydrochloride |
| IUPAC Name | 3-(aminomethyl)-1,2,4-oxadiazole-5-carboxamide;hydrochloride |
| InChI | InChI=1S/C4H6N4O2.ClH/c5-1-2-7-4(3(6)9)10-8-2;/h1,5H2,(H2,6,9);1H |
| InChI Key | RKEDXQOFNBFPAK-UHFFFAOYSA-N |
| MDL Number | MFCD21606191 |
| Molecular Formula | C4H7ClN4O2 |
| Molecular Weight | 178.5770 |
| SMILES | C1(C(N)=O)ON=C(CN)N=1.Cl |
| Synonyms | 3-(AMINOMETHYL)-1,2,4-OXADIAZOLE-5-CARBOXAMIDE HYDROCHLORIDE,
1361116-15-5,
ZX-CM008014,
MFCD21606191,
AKOS027325722,
3-(Aminomethyl)-1,2,4-oxadiazole-5-carboxamide hydrochloride, AldrichCPR,
3-Aminomethyl-[1,2,4]oxadiazole-5-carboxylic acid amidehydrochloride,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.576g/mol |
| Monoisotopic Mass | 178.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 108A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number