2098159-97-6
Product Name:
2-Propenoic acid, 3-[1-[2-(1,1-dimethylethoxy)ethyl]-1H-pyrazol-4-yl]-
Formula:
C12H18N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 238.28 g/mol |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 238.13174244 g/mol |
| Monoisotopic Mass | 238.13174244 g/mol |
| Topological Polar Surface Area | 64.4 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 284 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |