857530-80-4
Product Name:
3,5-DIMETHYLPYRAZOLE-4-BORONIC ACID, PINACOL ESTER
Formula:
C11H19BN2O2
Synonyms:
3,5-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2dioxaborolan-2-yl)-1H-pyrazole;3,5-Dimethyl-4-pyrazoleboronic acid pinacol ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 222.09 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 222.1539580 g/mol |
| Monoisotopic Mass | 222.1539580 g/mol |
| Topological Polar Surface Area | 47.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 267 |
| 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 |