HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1085444Generated: November 1, 2026
Methanethiol → 4-Methyl-6-methylthio-beta-carbolin-3-carboxylic acid methyl ester
https://huagongshe.com/reaction/1085444
Participants
| Role | Name | HCID | Charge |
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| Reactant | Methanethiol | HCID 878 | — |
| Reactant | Sodium Methoxide | HCID 10942334 | — |
| Reactant | 6-Bromo-4-methyl-beta-carbolin-3-carboxylic acid ethyl ester | HCID 13037328 | — |
| Reactant | Butyllithium | HCID 178418339 | — |
| Solvent | Methanol | HCID 887 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Solvent | N-methyl-2-pyrrolidone | HCID 13387 | — |
| Product | 4-Methyl-6-methylthio-beta-carbolin-3-carboxylic acid methyl ester | HCID 86738779 | — |
Reaction Steps
At -10° C. methylmercaptan is introduced into 150 ml of tetrahydrofuran. Within 2 hours, at -10° C., 100 ml of 1.6 molar butyl lithium solution (hexane) is added dropwise thereto. The whole is then stirred for 30 minutes and the solvent is then distilled off in vacuo at a bath temperature of 20° C. The lithium methylmercaptide thus prepared is dissolved in 100 ml of N-methylpyrrolidone. 10.2 g of 6-bromo-4-methyl-β-carbolin-3-carboxylic acid ethyl ester is added thereto, and the whole is heated for 24 hours under argon protecting gas for 24 hours at 100° C. For work-up, the mixture is stirred into 400 ml of ice water, extracted with ethyl acetate, and the extracts are washed with water until neutral. The crude product obtained in this manner is dissolved in 250 ml of methanol and after the addition of 1 g of sodium methylate, is boiled for 6 hours. The solvent is then distilled off in vacuo, 150 ml of saturated sodium hydrogen phosphate solution is added to the residue and extraction with ethyl acetate is carried out. After washing with water until neutral, drying with sodium sulphate, filtering and distilling off the solvent, 8.85 g of 4-methyl-6-methylthio-β-carbolin-3-carboxylic acid methyl ester is obtained, which is crystallized from diisopropyl ether. Melting point 186°-193° C. (decomposition).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US05010077 |
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| Source dataset | uspto-grants-1991_04 |
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| ORD ID | ord-fc06a29167184b189184c1f19e770fa5 |
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| Source note | uspto-grants-1991_04 |
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