RefChem:236996
1-[[2-(5,7-dichloro-1-benzofuran-2-yl)-5,5-dimethyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole
Also Known As: 1h-1,2,4-triazole,1-((2-|1H-1,2,4-Triazole,1-((2- -|1-((2-(5,7-Dichloro-2-benzofuranyl)-5,5-dimethyl-1,3-dioxan-2-yl)methyl)-1H-1,2,4-triazole|1H-1,2,4-Triazole, 1-((2-(5,7-dichloro-2-benzofuranyl)-5,5-dimethyl-1,3-dioxan-2-yl)methyl)-|1-((2-(5,7-Dichlorobenzofuran-2-yl)-5,5-dimethyl-1,3-dioxan-2-yl)methyl)-1H-1,2,4-triazole|1-[[2-(5,7-dichloro-1-benzofuran-2-yl)-5,5-dimethyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole|1-{[2-(5,7-Dichloro-1-benzofuran-2-yl)-5,5-dimethyl-1,3-dioxan-2-yl]methyl}-1H-1,2,4-triazole|1H-1,2,4-Triazole, 1-((2-(5,7-Dichloro-2-Benzofuranyl)-5,5-Dimethyl-1, 3-Dioxan-2-Yl)Methyl)-
| Molecular Formula | C17H17Cl2N3O3 |
|---|---|
| Molecular Weight | 381.0647 g/mol |
| LogP | 4.2571 |
| Topological Polar Surface Area | 62.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.0647 |
| Monoisotopic Mass | 381.0647 |
| Heavy Atoms | 25 |
| Complexity | 895.3988 |
Chemical Identifiers
| CAS Number | 98532-77-5 |
|---|---|
| SMILES | CC1(COC(OC1)(CN2C=NC=N2)C3=CC4=CC(=CC(=C4O3)Cl)Cl)C |
Product Overview
RefChem:236996 (CAS 98532-77-5), with molecular formula C17H17Cl2N3O3 and molecular weight 381.0647 g/mol. IUPAC: 1-[[2-(5,7-dichloro-1-benzofuran-2-yl)-5,5-dimethyl-1,3-dioxan-2-yl]methyl]-1,2,4-triazole.