862499-50-1
Product Name:
(1S,4S,8S)-5-BENZYL-8-METHOXY-1,8-DIMETHYL-2-(2'-METHYLPROPYL)-BICYCLO [2.2.2]OCTA-2,5-DIENE
Formula:
C22H30O
Synonyms:
(1S,4S,8S) Carreira DOLEFIN Ligand;(1S,4S,8S)-5-Benzyl-2-isobutyl-8-methoxy-1,8-dimethyl-2-bicyclo[2.2.2]octa-2,5-diene;(1S,4S,8S)--5-Benzyl-8-methoxy-1,8-dimethyl-2-(2′-methylpropyl)-bicyclo[2.2.2]octa-2,5-diene
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COMPUTED DESCRIPTORS
| Molecular Weight | 310.5 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 5 |
| Exact Mass | 310.229665576 g/mol |
| Monoisotopic Mass | 310.229665576 g/mol |
| Topological Polar Surface Area | 9.2 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 494 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |