HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1807789Generated: November 2, 2026
Ethyl 4-isocyanatobenzoate → HCID 59175898, compound
https://huagongshe.com/reaction/1807789
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethyl 4-isocyanatobenzoate | HCID 589805 | — |
| Reactant | HCID 86638576 | HCID 86638576 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | HCID 59175898 | HCID 59175898 | 73.7% |
Reaction Steps
2-(4-((4-(4-Aminophenyl)piperazin-1-yl)methyl)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol (0.461 mmol, 200 mg) and ethyl 4-isocyanatobenzoate (0.554 mmol, 0.060 mL, 106 mg) were combined in dichloromethane and heated in a microwave at 100° C. for 10 minutes. The reaction mixture was concentrated under vacuum. The residue was purified by acidic preparative HPLC and SCX chromatography to afford the title compound (212.3 mg). MS (ESI) m/z 625.2 [M+H]+
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08357679B2 |
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| Source dataset | uspto-grants-2013_01 |
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| ORD ID | ord-768c10f893104b929e52f6812e6b8e47 |
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| Source note | uspto-grants-2013_01 |
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