AC1MT0D5
ethyl 2-[5-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]acetate
Also Known As: ethyl 2-{5-oxo-4-[4-(trifluoromethoxy)phenyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetate|KS-000021SU|Ethyl 2-[5-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]acetate|9W-0867|SR-01000306995-1|Ethyl {5-oxo-4-[4-(trifluoromethoxy)phenyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetate|ethyl2-{5-oxo-4-[4-(trifluoromethoxy)phenyl]-4,5-dihydro-1H-1,2,4-triazol-1-yl}acetate
| Molecular Formula | C13H12F3N3O4 |
|---|---|
| Molecular Weight | 331.078 g/mol |
| LogP | 1.4957 |
| Topological Polar Surface Area | 75.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.078 |
| Monoisotopic Mass | 331.078 |
| Heavy Atoms | 23 |
| Complexity | 734.1584 |
Chemical Identifiers
| CAS Number | 866149-41-9 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)N(C=N1)C2=CC=C(C=C2)OC(F)(F)F |
Product Overview
AC1MT0D5 (CAS 866149-41-9), with molecular formula C13H12F3N3O4 and molecular weight 331.078 g/mol. IUPAC: ethyl 2-[5-oxo-4-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]acetate.
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