98519-49-4
Product Name:
1H-1,2,4-Triazole, 1-[[2-(2-benzofuranyl)-4-methyl-1,3-dioxolan-2-yl]methyl]-, cis- (9CI)
Formula:
C15H15N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 285.30 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 285.11134135 g/mol |
| Monoisotopic Mass | 285.11134135 g/mol |
| Topological Polar Surface Area | 62.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 383 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |