| CAS Number | 1609403-70-4 |
| Catalog Number | AG00J2E6 |
| Chemical Name | 3-amino-N,N-dimethyl-1H-1,2,4-triazole-5-carboxamide hydrate |
| IUPAC Name | 3-amino-N,N-dimethyl-1H-1,2,4-triazole-5-carboxamide;hydrate |
| InChI | InChI=1S/C5H9N5O.H2O/c1-10(2)4(11)3-7-5(6)9-8-3;/h1-2H3,(H3,6,7,8,9);1H2 |
| InChI Key | XEBHDRHJOBZMKR-UHFFFAOYSA-N |
| MDL Number | MFCD18381918 |
| Molecular Formula | C5H11N5O2 |
| Molecular Weight | 173.1731 |
| SMILES | C1(C(=O)N(C)C)NN=C(N)N=1.O |
| Synonyms | 3-Amino-N,N-dimethyl-1H-1,2,4-triazole-5-carboxamide hydrate,
1609403-70-4,
ZX-CM009245,
MFCD26959477,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.176g/mol |
| Monoisotopic Mass | 173.091g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 88.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number