HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2403736Generated: October 27, 2026
2-Phenylethyl Acetate → 4-(5-Bromo-2-chlorobenzoyl)phenethyl acetate
https://huagongshe.com/reaction/2403736
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 2-Phenylethyl Acetate | HCID 7654 | — |
| Reactant | 5-Bromo-2-chlorobenzoic acid | HCID 33127 | — |
| Reactant | Oxalyl chloride | HCID 65578 | — |
| Reactant | Aluminum(III) Chloride | HCID 6451240 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | 4-(5-Bromo-2-chlorobenzoyl)phenethyl acetate | HCID 59557742 | 26% |
Reaction Steps
To a solution of commercially available 5-bromo-2-chlorobenzoic acid (5 g, 21.23 mmol) in 30 mL of anhydrous DCM was added a catalytic amount of DMF followed by oxalyl chloride (1.95 mL, 22.3 mmol) and stirred for 2 h at room temperature. A mixture of aluminum trichloride (3.68 g, 27.6 mmol) and phenethyl acetate (3.38 mL, 21.23 mmol) in 15 mL DCM was cooled in an ice-bath and the acid chloride was transferred to it using a canula. The mixture was stirred at room temperature for 4 h. The mixture was poured into 100 mL of ice-cold water and the organic layer was isolated. The aqueous solution was extracted with 25 mL DCM. The combined organic solution was washed with brine (25 mL) and dried (Na2SO4), filtered and evaporated. Purification on silica gel using an ISCO column with 5:1 hexane:EtOAc followed by 10:1 hexane:EtOAc gave intermediate BF (2.1 g, yield 26%). 1H NMR (300 MHz, CDCl3): δ 8.12 (d, J=2.4 Hz, 1H), 7.71 (d, J=8.4 Hz, 1H), 7.59 (d, J=2.7 Hz, 1H), 7.56 (d, J=8.4 Hz, 1H), 7.36 (s, 1H), 7.33 (d, J=8.4 Hz, 1H), 7.30 (d, J=8.4 Hz, 1H), 4.31 (t, J=6.9, 6.6 Hz, 2H), 3.01 (t, J=6.9, 6.6 Hz, 2H), 2.04 (s, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08802637B2 |
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| Source dataset | uspto-grants-2014_08 |
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| ORD ID | ord-70d5dd28a09f4ea4afae12bc11d2929b |
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| Source note | uspto-grants-2014_08 |
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