2098087-53-5
Product Name:
1H-Pyrazole-4-acetic acid, 1-ethyl-3-(3-pyridinyl)-
Formula:
C12H13N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 231.25 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 231.100776666 g/mol |
| Monoisotopic Mass | 231.100776666 g/mol |
| Topological Polar Surface Area | 68 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 273 |
| 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 |