501913-38-8
Product Name:
4-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZONITRILE
Formula:
C14H12N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 224.26 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 224.094963011 g/mol |
| Monoisotopic Mass | 224.094963011 g/mol |
| Topological Polar Surface Area | 45.8 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 324 |
| 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 |