HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 63618Generated: October 26, 2026
Sulfuric Acid → HCID 118598114, compound
https://huagongshe.com/reaction/63618
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Sulfuric Acid | HCID 1118 | — |
| Reactant | Trimethylsilyl cyanide | HCID 82115 | — |
| Reactant | Aluminum(III) Chloride | HCID 6451240 | — |
| Reactant | 7-bromo-3,4-dihydro-2H-1-benzopyran-4-one | HCID 22335736 | — |
| Solvent | Acetic Acid | HCID 176 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | HCID 118598114 | HCID 118598114 | 45% |
Reaction Steps
To a solution of 7-bromochroman-4-one (2.0 g, 8.8 mmol) and AlCl3 (118 mg, 0.9 mmol) in toluene (10 mL) was added TMSCN (1.3 mL, 9.7 mmol). The solution was stirred at 40° C. for 1.5 h. The reaction was cooled to rt, and H2SO4 (1.0 mL) was added, followed by AcOH (13 mL) and more H2SO4 (4.3 mL). The reaction was heated to 130° C. and stirred for 6 h. The reaction was cooled, poured over H2O (100 mL) and filtered. The filter cake dissolved in THF (50 mL) and filtered. The combined organic solutions were concentrated to give 1.0 g (45%) of the crude title compound as an off-white solid. [M+H] calc'd for C10H8BrNO2, 254, 256. found 254, 256.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09447046B2 |
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| Source dataset | uspto-grants-2016_09 |
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| ORD ID | ord-4c7efe1c71174b10acaa9f517e2027b1 |
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| Source note | uspto-grants-2016_09 |
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