| CAS Number | 1214344-68-9 |
| Catalog Number | AG009Y9O(AGN-PC-0WBSCV) |
| Chemical Name | 2-Fluoro-5-(trifluoromethyl)pyrimidine |
| IUPAC Name | 2-fluoro-5-(trifluoromethyl)pyrimidine |
| InChI | InChI=1S/C5H2F4N2/c6-4-10-1-3(2-11-4)5(7,8)9/h1-2H |
| InChI Key | QEWJTWUFYSMONN-UHFFFAOYSA-N |
| MDL Number | MFCD13185662 |
| Molecular Formula | C5H2F4N2 |
| Molecular Weight | 166.0764 |
| SMILES | FC1=NC=C(C(F)(F)F)C=N1 |
| Synonyms | 2-fluoro-5-(trifluoromethyl)pyrimidine,
1214344-68-9,
SCHEMBL11287557,
DTXSID90602138,
QEWJTWUFYSMONN-UHFFFAOYSA-N,
1148AD,
BBL102705,
STL556511,
ZINC77012162,
AKOS017344325,
Pyrimidine, 2-fluoro-5-(trifluoromethyl)-,
C5H2F4N2,
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| Complexity | 127 |
| 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 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number