| CAS Number | 1220799-65-4 |
| Catalog Number | AG01FDU2(AGN-PC-3H4A02) |
| Chemical Name | 2-Fluoro-5-trifluoromethyl-pyrazine |
| IUPAC Name | 2-fluoro-5-(trifluoromethyl)pyrazine |
| InChI | InChI=1S/C5H2F4N2/c6-4-2-10-3(1-11-4)5(7,8)9/h1-2H |
| InChI Key | LDFYMGRDKCHQRZ-UHFFFAOYSA-N |
| MDL Number | MFCD22375205 |
| Molecular Formula | C5H2F4N2 |
| Molecular Weight | 166.0764 |
| SMILES | Fc1cnc(cn1)C(F)(F)F |
| Synonyms | 2-Fluoro-5-trifluoromethyl-pyrazine,
1220799-65-4,
DTXSID30735217,
ZINC85667190,
2-fluoro-5-(trifluoromethyl)pyrazine,
AKOS026671559,
Pyrazine, 2-fluoro-5-(trifluoromethyl)-,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.079g/mol |
| Monoisotopic Mass | 166.015g/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