HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 168Generated: October 25, 2026
1-Chloro-4-(trifluoromethyl)benzene → Methyl 2-methyl-2-[4-(trifluoromethyl)anilino]propanoate
https://huagongshe.com/reaction/168
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 1-Chloro-4-(trifluoromethyl)benzene | HCID 7394 | — |
| Reactant | Methyl 2-amino-2-methylpropanoate | HCID 4186341 | — |
| Reagent | Sodium t-butoxide | HCID 23676156 | — |
| Catalyst | Palladium (II) acetate | HCID 4144353 | — |
| Catalyst | Bis(adamantan-1-yl)(butyl)phosphane | HCID 11371790 | — |
| Solvent | (Trifluoromethyl)benzene | HCID 7368 | — |
| Product | Methyl 2-methyl-2-[4-(trifluoromethyl)anilino]propanoate | HCID 117559794 | 0% |
Reaction Steps
1-chloro-4-(trifluoromethyl)benzene (0.068 mL, 0.51 mmol), methyl 2-amino-2-methylpropanoate (0.05 g, 0.43 mmol),BUTYLDI-1-ADAMANTYLPHOSPHINE (0.015 g, 0.04 mmol), sodium 2-methylpropan-2-olate (0.082 g, 0.85 mmol) and diacetoxypalladium (4.79 mg, 0.02 mmol) was added to a microwave vial. (TRIFLUOROMETHYL)-BENZENE (0.5 mL) was used as solvent, before use the solvent was bubbled with nitrogen (1-1.2 mL/mmol amine). The mixture was bubbled with nitrogen before the vial was sealed. The mixture was heated in microwave at 180° for 60min.. The mixture was heated in microwave at 180° for 60min. No conversion of startingmaterial was observed.
Provenance & Evidence
| Source dataset | 750 AstraZeneca ELN dataset |
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| ORD ID | ord-d712f5c0551541748b4f06a98eb63af5 |
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| Source note | 750 AstraZeneca ELN dataset |
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