AC1LXS78
6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 11413236|6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole|6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole|6-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
CAS: 876887-63-7
| Molecular Formula | C12H7F3N4O2S |
|---|---|
| Molecular Weight | 328.02417 g/mol |
| LogP | 2.6428 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.02417 |
| Monoisotopic Mass | 328.02417 |
| Heavy Atoms | 22 |
| Complexity | 857.789 |
Chemical Identifiers
| CAS Number | 876887-63-7 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=NN4C(=NN=C4S3)C(F)(F)F |
Product Overview
AC1LXS78 (CAS 876887-63-7), with molecular formula C12H7F3N4O2S and molecular weight 328.02417 g/mol. IUPAC: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
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.
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