440096-63-9
Product Name:
3-acetyl-4-hydroxy-1-(hydroxymethyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one
Formula:
C13H12N2O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 292.24 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 292.06953611 g/mol |
| Monoisotopic Mass | 292.06953611 g/mol |
| Topological Polar Surface Area | 124 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 509 |
| 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 |