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HRID 516768作成日:2026年10月25日

Sodium Hydroxide → 6-bromo-1-(sec-butyl)-3-methyl-1H-indole-4-carboxylic acid

https://huagongshe.com/reaction/516768

反応式

関与物質

役割名称HCID仕込み量
反応物Sodium HydroxideHCID 14798—
反応物tert-Butyl methyl etherHCID 15413—
反応物Methyl 6-bromo-1-(sec-butyl)-3-methyl-1H-indole-4-carboxylateHCID 67465536—
溶媒MethanolHCID 887—
溶媒TetrahydrofuranHCID 8028—
生成物6-bromo-1-(sec-butyl)-3-methyl-1H-indole-4-carboxylic acidHCID 67465322—

反応手順

Methyl 6-bromo-1-(sec-butyl)-3-methyl-1H-indole-4-carboxylate (3.24 g, 9.99 mmol) was dissolved in methanol (30 mL) and tetrahydrofuran (THF) (7 mL). The contents were stirred for 5 min., and then aq. 3N NaOH (19.99 mL, 60.0 mmol) was added via addition funnel over 3 min. The contents rapidly became a yellow suspension and were stirred at room temperature for 65 h. The volatiles were removed in vacuo and the residue dissolved in water (60 mL). The contents were washed with ether (1×50 mL). The aq layer was cooled in an ice bath and adjusted to pH 3-4 with 1M HCl, from which an oily residue precipitated. The contents were extracted with EtOAc (2×60 mL). The combined organic layers were dried over magnesium sulfate, filtered through celite, and concentrated in vacuo. The residue obtained was treated with TBME, concentrated in vacuo, and then dried under hi vacuum to afford a yellow foam as 3.08 g (93%). 1H NMR (400 MHz, DMSO-d6) δ ppm 0.70 (t, J=7.33 Hz, 3H), 1.39 (d, J=6.82 Hz, 3H), 1.71-1.86 (m, 2H), 2.30 (s, 3H), 4.48-4.62 (m, 1H), 7.40-7.49 (m, 2H), 7.96 (d, J=1.77 Hz, 1H), 12.99 (s, 1H); LCMS=310.0/312.0 (MH+).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US09114141B2
出典データセットuspto-grants-2015_08
ORD IDord-280098a5c17e44c0a0e9ecc2de1de5f7
出典メモuspto-grants-2015_08