化工社化工社 化学情報印刷レポート · 研究参考用
3-Isopropylphenol → 4-Chloro-3-isopropylphenol
関与物質
| 役割 | 名称 | HCID | 仕込み量 |
|---|---|---|---|
| 反応物 | 3-Isopropylphenol | HCID 12059 | — |
| 反応物 | Tert-Butyl hypochlorite | HCID 521297 | — |
| 溶媒 | Benzene--trichloromethane (1/1) | HCID 22101329 | — |
| 生成物 | 4-Chloro-3-isopropylphenol | HCID 18327844 | 104.4% |
| 生成物 | 2-Chloro-5-isopropylphenol | HCID 59596487 | — |
反応手順
A solution of 3-isopropyl phenol (10.0 g, 73.4 mmol) in 350 mL 9:1 benzene/CHCl3 was cooled to 0° C. Hypochlorous acid tert-butyl ester (8.77 g, 80.8 mmol) was added drop-wise over 5 min and the mixture was allowed to warm to rt. After 16 h the mixture was concentrated in vacuo to give a crude oil. Purification via flash chromatography afforded 2-chloro-5-isopropyl-phenol and 4-chloro-3-isopropyl-phenol (6.540 g, 52%) as a 7:3 inseparable mixture of isomers in the form of a pale yellow oil. The combined regioisomers were used together in the following step.
情報源と証拠
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 特許番号 | US08008313B2 |
| 出典データセット | uspto-grants-2011_08 |
| ORD ID | ord-1f2bebbab6744f2d9b5a1ba42092bc57 |
| 出典メモ | uspto-grants-2011_08 |