AC1LCEC4
ethyl 7-oxo-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate
Also Known As: ethyl 7-oxo-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate|ethyl 7-oxo-2-(trifluoromethyl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate|Ethyl 7-oxo-2-(trifluoromethyl)-7H-1,3,4-thiadiazolo[3,2-a]pyrimidine-5-carboxylate|7H-1,3,4-Thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid,7-oxo-2-(trifluoromethyl)-, ethyl ester|Ethyl 7-oxo-2-(trifluoromethyl)(7H)-1,3,4-thiadiazolo[3,2-a]pyrimidine-5-carboxylate|
7-Oxo-2-trifluoromethyl-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylic acid ethyl ester|ethyl 7-oxo-2-(trifluoromethyl)-4-hydro-1,3,4-thiadiazolino[3,2-a]pyrimidine-5 -carboxylate
| Molecular Formula | C9H6F3N3O3S |
|---|---|
| Molecular Weight | 293.0082 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 96.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.0082 |
| Monoisotopic Mass | 293.0082 |
| Heavy Atoms | 19 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 82077-86-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=O)N=C2N1N=C(S2)C(F)(F)F |
| InChIKey | DQKKSABMYSEKLC-UHFFFAOYSA-N |
Product Overview
AC1LCEC4 (CAS 82077-86-9), with molecular formula C9H6F3N3O3S and molecular weight 293.0082 g/mol. IUPAC: ethyl 7-oxo-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxylate.
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