1073372-08-3
Product Name:
4-(2-Cyanoethylaminocarbonyl)phenylboronic acid, propanediol cyclic ester
Formula:
C13H15BN2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 258.08 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 258.1175725 g/mol |
| Monoisotopic Mass | 258.1175725 g/mol |
| Topological Polar Surface Area | 71.4 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 341 |
| 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 |