39257-86-8
Product Name:
2H-Isoindole-2-butanoic acid, α-bromo-1,3-dihydro-1,3-dioxo-, phenylmethyl ester
Formula:
C19H16BrNO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 402.2 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 401.02627 g/mol |
| Monoisotopic Mass | 401.02627 g/mol |
| Topological Polar Surface Area | 63.7 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 494 |
| 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 |