| CAS Number | 723286-86-0 |
| Catalog Number | AG00FHF0 |
| Chemical Name | 5-Methyl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine |
| IUPAC Name | 5-methyl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine |
| InChI | InChI=1S/C7H5F3N4/c1-4-2-11-3-5-12-13-6(14(4)5)7(8,9)10/h2-3H,1H3 |
| InChI Key | MBHVCNBINCRYSW-UHFFFAOYSA-N |
| MDL Number | MFCD12547177 |
| Molecular Formula | C7H5F3N4 |
| Molecular Weight | 202.1366 |
| SMILES | FC(F)(F)C1N2C(C=NC=C2C)=NN=1 |
| Synonyms | 5-methyl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine,
723286-86-0,
SCHEMBL5935860,
MBHVCNBINCRYSW-UHFFFAOYSA-N,
MFCD12547177,
ZINC96032449,
5-Methyl-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazine,
2-bromo-1-(chloromethyl)-4-(trifluoromethyl)benzene,
480438-96-8,
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| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.14g/mol |
| Monoisotopic Mass | 202.047g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number