Reaction #4127195
Related Literature (1)
openreactiondata ↗doi:10.1039/C8SC04228D
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-10a93ddc1e974addb3643e05d407ebc5No renderable structure data available
C1=CC=C(C(=C1)C(C(F)(F)F)O)IChemical Intermediate
Structures, identifiers and computed properties have been matched to the database record by CAS.
| Intermediates | 2,2,2-trifluoro-1-(2-iodophenyl)ethanol |
|---|---|
| IUPAC Name | — |
| CAS Number | 1033804-98-6 |
| Database ID | 66743698 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2,2,2-trifluoro-1-(2-iodophenyl)ethanol (CAS 1033804-98-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
Potential Applications
For professional research and industrial use only
Database ID 66743698
Safety Notice
For professional research and industrial use only. Review the supplier safety data sheet before handling.
Synthesis data
12 reactions · 12 references
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-10a93ddc1e974addb3643e05d407ebc5Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-7bac2e54fb3c4ac4b67a64c2d775c941Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-fe9242612bbc4770be7ad901fdda61d7Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-10a93ddc1e974addb3643e05d407ebc5Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-7bac2e54fb3c4ac4b67a64c2d775c941Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-fe9242612bbc4770be7ad901fdda61d7Conditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3-phenyl pyrazole (0.144 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were taken in a 20 ml pressure tube and the mixture was heated at 130° C. (oil bath temperature) for 12 h. The mixture was diluted with ethyl acetate and washed with H2O (2×20 ml), brine, and dried over sodium sulfate. Removal of solvent gave a crude product, which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to afford 2,2,2-trifluoro-1-[2-(3-phenyl-pyrazol-1-yl)-phenyl]-ethanol (75 mg). washed with H2O (2×20 ml), brine dried over sodium sulfate Removal of solvent gave a crude product, which was purified by ISCO column chromatography
Source ID: ord-03819cb72c1648818eb5f840af321ef5Conditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3-phenyl pyrazole (0.144 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were taken in a 20 ml pressure tube and the mixture was heated at 130° C. (oil bath temperature) for 12 h. The mixture was diluted with ethyl acetate and washed with H2O (2×20 ml), brine, and dried over sodium sulfate. Removal of solvent gave a crude product, which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to afford 2,2,2-trifluoro-1-[2-(3-phenyl-pyrazol-1-yl)-phenyl]-ethanol (75 mg). washed with H2O (2×20 ml), brine dried over sodium sulfate Removal of solvent gave a crude product, which was purified by ISCO column chromatography
Source ID: ord-03819cb72c1648818eb5f840af321ef5Conditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3,5-dimethyl pyrazole (0.096 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were combined in a 20 ml pressure tube and the mixture was heated at 130° C. (oil bath temperature) for 12 h. The mixture was diluted with ethyl acetate and washed with H2O (2×20 ml), brine, and dried over sodium sulfate. Removal of solvent gave crude product, which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to give 1-[2-(3,5-dimethyl-pyrazol-1-yl)-phenyl]-2,2,2-trifluoro-ethanol (120 mg). washed with H2O (2×20 ml), brine dried over sodium sulfate Removal of solvent gave crude product, which was purified by ISCO column chromatography
Source ID: ord-aafc0fc3e4e04af1b6ec7dc966744a1eConditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3-trifluoromethyl pyrazole (0.136 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were combined in a 20 ml pressure tube. The mixture was heated at 130° C. (oil bath temperature) for 12 h. The reaction mixture was diluted with ethyl acetate, and washed with H2O (2×20 ml), brine, and dried by sodium sulfate. Removal of solvent gave crude product which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to give 140 mg of 2,2,2-trifluoro-1-[2-(3-trifluoro methyl-pyrazol-1-yl)-phenyl]-ethanol. washed with H2O (2×20 ml), brine dried by sodium sulfate Removal of solvent gave crude product which was purified by ISCO column chromatography
Source ID: ord-8aad8e04b1e448bd9266e21d0687e440Conditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3-trifluoromethyl pyrazole (0.136 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were combined in a 20 ml pressure tube. The mixture was heated at 130° C. (oil bath temperature) for 12 h. The reaction mixture was diluted with ethyl acetate, and washed with H2O (2×20 ml), brine, and dried by sodium sulfate. Removal of solvent gave crude product which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to give 140 mg of 2,2,2-trifluoro-1-[2-(3-trifluoro methyl-pyrazol-1-yl)-phenyl]-ethanol. washed with H2O (2×20 ml), brine dried by sodium sulfate Removal of solvent gave crude product which was purified by ISCO column chromatography
Source ID: ord-8aad8e04b1e448bd9266e21d0687e440Conditions: temp:130.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2,2,2-Trifluoro-1-(2-iodo-phenyl)-ethanol (0.331 g, 1.1 mmol), 3-phenyl pyrazole (0.144 g, 1.0 mmol), CuI (0.019 g, 0.1 mmol), K2CO3 (0.290 g, 2.1 mmol), (1R,2R)-N,N′-dimethyl-cyclohexane-1,2-diamine (0.028 g, 0.2 mmol) and toluene (10 ml) were taken in a 20 ml pressure tube and the mixture was heated at 130° C. (oil bath temperature) for 12 h. The mixture was diluted with ethyl acetate and washed with H2O (2×20 ml), brine, and dried over sodium sulfate. Removal of solvent gave a crude product, which was purified by ISCO column chromatography using 5-10% ethyl acetate in hexane as solvent to afford 2,2,2-trifluoro-1-[2-(3-phenyl-pyrazol-1-yl)-phenyl]-ethanol (75 mg). washed with H2O (2×20 ml), brine dried over sodium sulfate Removal of solvent gave a crude product, which was purified by ISCO column chromatography
Source ID: ord-835fc95833c2480d8a9d7c9e1cf7f183PubChem References
These sources are listed in the compound's public database record.
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