HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1991357Generated: October 31, 2026
p-Toluenesulfonic acid → HCID 24993956, compound
https://huagongshe.com/reaction/1991357
Participants
| Role | Name | HCID | Charge |
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| Reactant | p-Toluenesulfonic acid | HCID 6101 | — |
| Reactant | 1,3-Cyclopentanedione | HCID 77466 | — |
| Reactant | HCID 21099325 | HCID 21099325 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | HCID 24993956 | HCID 24993956 | — |
Reaction Steps
To a solution of 12.3 mg (0.26 mmol) of (3aR,4R,5S,7aR)-5-{(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}4-(4-fluorophenyl)octahydro-1H-isoindole (Example 2) in -2 mL dry toluene was added 2.7 mg (0.028 mmol) cyclopentane-1,3-dione and a catalytic amount (˜0.5 mg) of PTSA. The resulting mixture was heated at reflux for 16 hr. The solvent was removed vacuum and the residue was purified by prep TLC eluting with EtOAc/MeOH (95/5) to afford the title compound. 1H-NMR (CDCl3): δ: 7.73 (1H, s), 7.20 (2H, s), 7.03-6.90 (2H, m), 4.98, 4.80 (1H, s), 4.50 (1H, m), 3.62-3.18 (2H, m), 3.30-3.18 (3H, m), 3.15, 2.97 (1H, d, J=11.2 Hz), 2.68 (2H, m), 2.55-2.40 (4H, m), 2.17 (1H, m), 2.20 (1H, m), 2.00 (1H, m), 1.85 (1H, m), 1.62 (1H, m), 1.33 (3H, d, J=6.2 Hz). MS: (MH)+556.0.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07645790B2 |
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| Source dataset | uspto-grants-2010_01 |
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| ORD ID | ord-e9c8c0476b374fef8f78ace5f5f95506 |
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| Source note | uspto-grants-2010_01 |
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