1503758-76-6
Product Name:
1H-Azepine-1-carboxylic acid, hexahydro-3-hydroxy-3-methyl-, 1,1-dimethylethyl e…
Formula:
C12H23NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 229.32 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 229.16779360 g/mol |
| Monoisotopic Mass | 229.16779360 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 260 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |