899822-99-2
Product Name:
3-(hydroxymethyl)-3-nitro-1-(4-octylphenyl)-Ben
Formula:
C19H31NO5
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COMPUTED DESCRIPTORS
| Molecular Weight | 353.5 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 12 |
| Exact Mass | 353.22022309 g/mol |
| Monoisotopic Mass | 353.22022309 g/mol |
| Topological Polar Surface Area | 107 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 359 |
| 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 |