1373046-75-3
Product Name:
rac-4-(2-AMino-3,3-diMethyl-1-oxobutyl)benzonitrile Hydrochloride
Formula:
C13H18ClN2O+
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COMPUTED DESCRIPTORS
| Molecular Weight | 253.75 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 253.1107659 g/mol |
| Monoisotopic Mass | 253.1107659 g/mol |
| Topological Polar Surface Area | 45.7 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 1 |
| Complexity | 300 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |