HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 587204Generated: October 29, 2026
HCID 86675133, compound → HCID 86675132, compound
https://huagongshe.com/reaction/587204
Participants
| Role | Name | HCID | Charge |
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| Reactant | HCID 86675133 | HCID 86675133 | — |
| Solvent | Phosphorus oxychloride | HCID 24813 | — |
| Product | HCID 86675132 | HCID 86675132 | — |
Reaction Steps
A solution of (E)-N-(2-(2-(cyclopropanecarbonyl)hydrazinyl)-2-oxoethyl)-4-(3-(3,5-dichlorophenyl)-4,4,4-trifluorobut-1-enyl)-2-methylbenzamide (200 mg, 0.379 mmol) in phosphoryl chloride (POCl3, 2.0 mL) was stirred at ambient temperature for 10 min, then the resultant reaction mixture was heated to 50° C. for 1 h. The reaction mixture was quenched with ice water at 0° C. and extracted with EtOAc. The combined EtOAc layer was washed with saturated sodium bicarbonate (NaHCO3) solution and brine solution, dried over anhydrous Na2SO4, and concentrated under reduced pressure. Purification by flash column chromatography (SiO2, 100-200 mesh; eluting with 50% EtOAc/pet ether) afforded the title compound as a light brown gummy material (70.0 mg, 36%): 1H NMR (400 MHz, CDCl3) δ 7.43 (m, 2H), 7.27 (m, 2H), 7.23 (m, 2H), 6.58 (d, J=16.0 Hz, 1H), 6.41 (dd, J=16.0, 7.6 Hz, 1H), 4.79 (d, J=5.6 Hz, 2H), 4.14 (m, 1H), 2.48 (s, 3H), 2.18 (m, 1H), 1.16 (m, 4H); ESIMS m/z 509.89 ([M+H]+); IR (thin film) 1666, 1166, 1112, 800 cm−1.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09226500B2 |
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| Source dataset | uspto-grants-2016_01 |
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| ORD ID | ord-1dfa790d9d064948908cc2e593dad27d |
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| Source note | uspto-grants-2016_01 |
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