RefChem:344491
ethyl 6-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: Ethyl 6-(nonafluorobutyl)-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate|ethyl 6-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS: 281189-83-1
| Molecular Formula | C17H13F9N2O2S |
|---|---|
| Molecular Weight | 480.0554 g/mol |
| LogP | 4.4908 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.0554 |
| Monoisotopic Mass | 480.0554 |
| Heavy Atoms | 31 |
| Complexity | 885.33844 |
Chemical Identifiers
| CAS Number | 281189-83-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC=CC=C2)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
Product Overview
RefChem:344491 (CAS 281189-83-1), with molecular formula C17H13F9N2O2S and molecular weight 480.0554 g/mol. IUPAC: ethyl 6-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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