HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2233600Generated: October 30, 2026
Triethylamine → 4-(4,4-Dimethyl-5-imino-2-oxo-1-imidazolidinyl)-2-trifluoromethyl-benzonitrile
https://huagongshe.com/reaction/2233600
Participants
| Role | Name | HCID | Charge |
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| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | 2-Amino-2-methylpropionitrile | HCID 88022 | — |
| Reactant | 4-Isocyanato-2-(trifluoromethyl)benzonitrile | HCID 11063739 | — |
| Solvent | 1,2-Dichloroethane | HCID 11 | — |
| Product | 4-(4,4-Dimethyl-5-imino-2-oxo-1-imidazolidinyl)-2-trifluoromethyl-benzonitrile | HCID 22116948 | 47.3% |
Reaction Steps
To a solution of compound 9 (641 mg, 7.62 mmol) and triethylamine (168 mg, 1.66 mmol) in 1,2 dichloroethane (8.4 mL) at 0° C. under argon was dropwise added a solution of the isocyanate 8a (1.54 g, 7.28 mmol) in 1,2 dichloroethane (3.5 mL). The solution was stirred at 0° C. for 35 min and the ice bath was then removed and stirred at room temperature for an additional 30 min. The solution was then evaporated to dryness and purified by flash chromatography using EtOAc/Hexane (6:4) as an eluant to give pure compound 10a (1.02 g, 47%). 1H NMR (300 MHz, Acetone-d6) δ: 1.54 (m, 6H), 7.45 (broad s, 1H), 8.12 (d, 1H, J=8.46 Hz), 8.29 (dd, 1H, J1=6.90 Hz, J2=1.61 Hz), 8.46 (s, 1H), 8.51 (s, 1H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07709516B2 |
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| Source dataset | uspto-grants-2010_05 |
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| ORD ID | ord-0cd0bf3084fb4e8b9b7d888641780fc6 |
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| Source note | uspto-grants-2010_05 |
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