Reaction #4111396
Related Literature (1)
openreactiondata ↗doi:10.1039/C8SC04228D
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-458c21b6ecaf43238954dad7cf61790dNo renderable structure data available
C1=C(C=C(C(=C1F)F)F)C=OChemical Intermediate
Structures, identifiers and computed properties have been matched to the database record by CAS.
| Intermediates | 3,4,5-trifluorobenzaldehyde |
|---|---|
| IUPAC Name | — |
| CAS Number | 132123-54-7 |
| Database ID | 2776954 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3,4,5-trifluorobenzaldehyde (CAS 132123-54-7) 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 2776954
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-458c21b6ecaf43238954dad7cf61790dConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-b684ebc294bc450ca6c605ca29943394Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-a1fae320bd2a4fce8481780dd7334d02Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-2262cccfcc814ea598dbe366f4c0fba5Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-a6d58da624224210991388de2cbe1d73Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-11df342475e7489081bf504ae03093b8Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-d4c91e237b834c3299e8cd3397c99db9Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-921f2e31c3d24278a404dc330cc8f319Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-fbe79bdab503488cad598f73a99c288fConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: An ethereal solution (17.41 ml, 52.24 mmol, 3M) of MeMgBr was slowly added at −78° C. to a solution of 3,4,5-trifluorobenzaldehyde (6.96 g, 43.53 mmol) in THF (125 ml). The reaction mixture was stirred at room temperature for 16 h and was cooled (0° C.) and was quenched, sequentially, with excess ethyl acetate (10 ml) and water (5 ml). Excess anhydrous MgSO4 (5 g) was added and stirred for 30 minutes at room temperature. The suspension was filtered over celite and the solids were washed with ethyl acetate (2×25 ml). The combined filtrate was evaporated to obtain the product in quantitative yield (7.65 g). was cooled (0° C.) was quenched Excess anhydrous MgSO4 (5 g) was added stirred for 30 minutes at room temperature The suspension was filtered over celite the solids were washed with ethyl acetate (2×25 ml) The combined filtrate was evaporated to obtain the product in quantitative yield (7.65 g)
Source ID: ord-0ed51421be164c9faddace59a5675b2fConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: To a cooled (−5° C.) solution of 3,4,5-trifluorobenzaldehyde (7.0 g, 43.75 mmol) in a mixture (50 ml, 9:1) of THF and water NaBH4 (1.662 g, 43.75 mmol) was slowly added in portions over a period of 30 min. The reaction mixture was allowed to attain room temperature over a period of 2 h and carefully poured into ice-cold dil HCl (200 ml, IN). The oily layer was extracted into CH2Cl2 (250 ml) and the organic layer washed with water (200 ml), dried (MgSO4) and evaporated. The crude product (7.08 g, quantitative) obtained was taken forward without further purification. was slowly added in portions over a period of 30 min The oily layer was extracted into CH2Cl2 (250 ml) the organic layer washed with water (200 ml) dried (MgSO4) evaporated
Source ID: ord-ed8ac967d5444b04840596a58310026bConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: An ethereal solution (17.41 ml, 52.24 mmol, 3M) of MeMgBr was slowly added at −78° C. to a solution of 3,4,5-trifluorobenzaldehyde (6.96 g, 43.53 mmol) in THF (125 ml). The reaction mixture was stirred at room temperature for 16 h and was cooled (0° C.) and was quenched, sequentially, with excess ethyl acetate (10 ml) and water (5 ml). Excess anhydrous MgSO4 (5 g) was added and stirred for 30 minutes at room temperature. The suspension was filtered over celite and the solids were washed with ethyl acetate (2×25 ml). The combined filtrate was evaporated to obtain the product in quantitative yield (7.65 g). was cooled (0° C.) was quenched Excess anhydrous MgSO4 (5 g) was added stirred for 30 minutes at room temperature The suspension was filtered over celite the solids were washed with ethyl acetate (2×25 ml) The combined filtrate was evaporated to obtain the product in quantitative yield (7.65 g)
Source ID: ord-34d5847d156e48e4a42c87601548d2ffPubChem References
These sources are listed in the compound's public database record.
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