| CAS Number | 1186195-51-6 |
| Catalog Number | AG0096F3(AGN-PC-0WBSQ5) |
| Chemical Name | 2-Methyl-5-(trifluoromethyl)pyrazine |
| IUPAC Name | 2-methyl-5-(trifluoromethyl)pyrazine |
| InChI | InChI=1S/C6H5F3N2/c1-4-2-11-5(3-10-4)6(7,8)9/h2-3H,1H3 |
| InChI Key | XZOKPWSKJRCLQO-UHFFFAOYSA-N |
| MDL Number | MFCD12546943 |
| Molecular Formula | C6H5F3N2 |
| Molecular Weight | 162.1125 |
| SMILES | Cc1cnc(C(F)(F)F)cn1 |
| Synonyms | 2-METHYL-5-(TRIFLUOROMETHYL)PYRAZINE,
1186195-51-6,
2-Methyl-5-trifluoromethyl-pyrazine,
SCHEMBL12296398,
KS-00003KRU,
DTXSID20672324,
XZOKPWSKJRCLQO-UHFFFAOYSA-N,
BBL101013,
STL554807,
ZINC71773600,
AKOS005256353,
FS-2713,
Pyrazine, 2-methyl-5-(trifluoromethyl)-,
2-Methyl-5-(trifluoromethyl)pyrazine, 96%,
X-3972,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.115g/mol |
| Monoisotopic Mass | 162.04g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number