383147-61-3
Product Name:
2-([1-(4-ACETYLPHENYL)-1H-PYRROL-2-YL]METHYLENE)MALONONITRILE
Formula:
C16H11N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 261.28 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 261.090211983 g/mol |
| Monoisotopic Mass | 261.090211983 g/mol |
| Topological Polar Surface Area | 69.6 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 478 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |