121512-91-2
Product Name:
PER-O-ACETYL-ALPHA-THIOETHYL-N-ACETYLNEURAMINIC METHYL ESTER
Formula:
C22H33NO12S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 535.6 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 16 |
| Exact Mass | 535.17234666 g/mol |
| Monoisotopic Mass | 535.17234666 g/mol |
| Topological Polar Surface Area | 195 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 849 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 6 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |