187225-50-9
Product Name:
JR-13989, Methyl 3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxylate, 95%
Formula:
C11H9ClN2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 252.65 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 252.0301698 g/mol |
| Monoisotopic Mass | 252.0301698 g/mol |
| Topological Polar Surface Area | 75.2 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 290 |
| 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 |