| CAS Number | 1221724-51-1 |
| Catalog Number | AG01A87B |
| Chemical Name | 3-(1H-1,2,4-triazol-1-yl)propanimidamide dihydrochloride |
| IUPAC Name | 3-(1,2,4-triazol-1-yl)propanimidamide;dihydrochloride |
| InChI | InChI=1S/C5H9N5.2ClH/c6-5(7)1-2-10-4-8-3-9-10;;/h3-4H,1-2H2,(H3,6,7);2*1H |
| InChI Key | JZPHUYUGIYLRBP-UHFFFAOYSA-N |
| MDL Number | MFCD15209651 |
| Molecular Formula | C5H11Cl2N5 |
| Molecular Weight | 212.0803 |
| SMILES | Cl.Cl.NC(CCN1N=CN=C1)=N |
| Synonyms | 3-(1H-1,2,4-triazol-1-yl)propanimidamide dihydrochloride,
1221724-51-1,
EN300-60914,
AC1Q3AQI,
CTK7D2015,
AKOS016905422,
MCULE-6488242177,
NE39279,
Z969560750,
|
| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.039g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.078g/mol |
| Monoisotopic Mass | 211.039g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number