Catalog | OFC1193721399 |
CAS | 1193721-39-9 |
Category | Fluorinated Pyrimidines |
Synonyms | N-Methyl-4-(trifluoromethyl)pyrimidin-2-amine |
Purity | >95% |
MDL Number | MFCD13176794 |
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IUPAC Name | N-methyl-4-(trifluoromethyl)pyrimidin-2-amine |
InChI Key | WIQCREASEVWQBF-UHFFFAOYSA-N |
Isomeric SMILES | CNC1=NC=CC(=N1)C(F)(F)F |
Molecular Formula | C6H6F3N3 |
Molecular Weight | 177.13 |
Melting Point | 67-69 °C |
XLogP3-AA | 1.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 1 |
Exact Mass | 177.05138169 g/mol |
Monoisotopic Mass | 177.05138169 g/mol |
Topological Polar Surface Area | 37.8Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 148 |
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