AC1LKOF2
1-(4-bromophenyl)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: AN-698/42147565|1-(4-bromophenyl)-2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone|1-(4-bromophenyl)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
CAS: 665018-96-2
| Molecular Formula | C18H16BrN3O2S |
|---|---|
| Molecular Weight | 417.01465 g/mol |
| LogP | 4.1316 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.01465 |
| Monoisotopic Mass | 417.01465 |
| Heavy Atoms | 25 |
| Complexity | 850.5176 |
Chemical Identifiers
| CAS Number | 665018-96-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Br)COC3=CC=CC=C3 |
Product Overview
AC1LKOF2 (CAS 665018-96-2), with molecular formula C18H16BrN3O2S and molecular weight 417.01465 g/mol. IUPAC: 1-(4-bromophenyl)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone.
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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