106535-28-8
Product Name:
Ethanone, 1-(1-methyl-1H-1,2,4-triazol-5-yl)- (9CI)
Formula:
C5H7N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 125.13 g/mol |
|---|---|
| XLogP3 | 0 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 125.058911855 g/mol |
| Monoisotopic Mass | 125.058911855 g/mol |
| Topological Polar Surface Area | 47.8 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 125 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |