15095-75-7
Product Name:
Alanine, N-[2-(methylsulfonyl)ethyl]-3-phenyl-, DL- (8CI)
Formula:
C12H17NO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 271.33 g/mol |
|---|---|
| XLogP3 | -2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 271.08782920 g/mol |
| Monoisotopic Mass | 271.08782920 g/mol |
| Topological Polar Surface Area | 91.8 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 355 |
| 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 |