127389-38-2
Product Name:
3-[4-(1,1-DIMETHYLETHYL)PHENOXY]-BETA-OXO-BENZENEPROPANENITRILE
Formula:
C19H19NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 293.4 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 293.141578849 g/mol |
| Monoisotopic Mass | 293.141578849 g/mol |
| Topological Polar Surface Area | 50.1 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 421 |
| 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 |