309736-93-4
Product Name:
JR-13592, Ethyl 1-(4-chlorobenzyl)-5-methyl-1H-pyrazole-4-carboxylate, 97%
Formula:
C14H15ClN2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 278.73 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 278.0822054 g/mol |
| Monoisotopic Mass | 278.0822054 g/mol |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 306 |
| 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 |