| CAS Number | 1956377-47-1 |
| Catalog Number | AG01DTS5 |
| Chemical Name | 2,8-Dimethyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyrazin-6(5H)-one |
| IUPAC Name | 2,8-dimethyl-7,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-6-one |
| InChI | InChI=1S/C7H10N4O/c1-4-7-9-5(2)10-11(7)3-6(12)8-4/h4H,3H2,1-2H3,(H,8,12) |
| InChI Key | JVHSTEANIQIQDW-UHFFFAOYSA-N |
| MDL Number | MFCD29921079 |
| Molecular Formula | C7H10N4O |
| Molecular Weight | 166.1805 |
| SMILES | CC1=NN2C(C(NC(C2)=O)C)=N1 |
| Synonyms | 2,8-Dimethyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyrazin-6(5H)-one,
1956377-47-1,
MFCD29921079,
AKOS027335861,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.184g/mol |
| Monoisotopic Mass | 166.085g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 59.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number