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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1042528Generated: October 31, 2026

Acetic Acid → HCID 57750059, compound

https://huagongshe.com/reaction/1042528

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantBenzaldehydeHCID 240—
ReactantSodium BicarbonateHCID 516892—
ReactantSodium triacetoxyborohydrideHCID 5049666—
ReactantHCID 57750067HCID 57750067—
SolventTrifluoroacetic acid methylene chlorideHCID 21863450—
SolventMeOH tetrahydrofuranHCID 21899815—
ProductHCID 57750059HCID 5775005966.6%

Reaction Steps

A solution of 2-tert-butyl 8-methyl 3,4-dihydro-1H-pyrido[4,3-b]indole-2,8(5H)-dicarboxylate (0.5 g, 1.5 mmol) in dichloromethane/trifluoroacetic acid (1:1, 10 mL) was stirred at room temperature for 1 h. The reaction mixture was then concentrated, diluted with acetic acid (5 mL) and concentrated again to give an oily residue. The residue was dissolved in THF/MeOH (4:1, 10 mL) followed by the addition of benzaldehyde (170 μL, 180 mg, 1.7 mmol), sodium triacetoxyborohydride (485 mg, 2.3 mmol) and acetic acid (175 μL, 185 mg, 3.1 mmol). Additional amounts of benzaldehyde (4×170 μL) and sodium triacetoxyborohydride (4×485 mg) were added over the course of the ensuing 8 h. The resulting reaction mixture was stirred at room temperature overnight then poured over saturated sodium bicarbonate solution (30 mL). The aqueous layer was then extracted with dichloromethane (3×30 mL) and the combined organic layer was washed with water (2×30 mL), dried over MgSO4, filtered and concentrated. Column chromatography (neat dichloromethane→3% MeOH/CH2Cl2) provided methyl 2-benzyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-carboxylate as a white crystalline solid (320 mg, 66%). 1H NMR (CD3OD): δ 8.17 (1H, d, J=1.1 Hz); 7.73 (1H, dd, J=8.7, 1.8 Hz); 7.44-7.27 (6H, m); 3.88 (3H, s); 3.83 (2H, br s); 3.73 (2H, br s) 2.95-2.88 (4H, m). MS (M+H)+=321.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08557822B2
Source datasetuspto-grants-2013_10
ORD IDord-6c0bcc99134f412c9c3de14cd0938ac6
Source noteuspto-grants-2013_10