| CAS Number | 2031269-41-5 |
| Catalog Number | AG01B7BY |
| Chemical Name | 2-(Trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine hydrochloride |
| IUPAC Name | 2-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride |
| InChI | InChI=1S/C7H8F3N3.ClH/c8-7(9,10)6-3-5-4-11-1-2-13(5)12-6;/h3,11H,1-2,4H2;1H |
| InChI Key | QWVDHDBCUIMDLI-UHFFFAOYSA-N |
| MDL Number | MFCD28893716 |
| Molecular Formula | C7H9ClF3N3 |
| Molecular Weight | 227.6147 |
| SMILES | Cl.FC(C1=NN2C(CNCC2)=C1)(F)F |
| Synonyms | 2-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine hydrochloride,
2031269-41-5,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.615g/mol |
| Monoisotopic Mass | 227.044g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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