HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 2274059Erstellt: 25. Oktober 2026
Thionyl Chloride → 5-(Chloromethyl)-2-cyclohexylbenzonitrile
https://huagongshe.com/reaction/2274059
Beteiligte Stoffe
| Rolle | Name | HCID | Einwaage |
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| Edukt | Thionyl Chloride | HCID 24386 | — |
| Edukt | 2-Cyclohexyl-5-(hydroxymethyl)benzonitrile | HCID 58020513 | — |
| Produkt | 5-(Chloromethyl)-2-cyclohexylbenzonitrile | HCID 67211353 | 89,4% |
Reaktionsschritte
To 2-cyclohexyl-5-(hydroxymethyl)benzonitrile (190.5 mg, 0.885 mmol) was added thionyl chloride (5.0 mL, 68.1 mmol). The mixture was heated at 50° C. for 2 h and then room temperature overnight. The mixture was poured into an ice and stirred for 5 min. The mixture was extracted with dichloromethane. The organic layer was washed with saturated aqueous sodium bicarbonate solution, dried over anhydrous sodium sulfate and concentrated under reduced pressure to provide the title compound as a white solid (184.9 mg). LCMS m/z=234.1 [M+H]+; 1H NMR (400 MHz, CDCl3) δ ppm 1.23-1.31 (m, 1H), 1.40-1.52 (m, 4H), 1.76-1.82 (m, 1H), 1.83-1.92 (m, 4H), 2.93-3.03 (m, 1H), 4.55 (s, 2H), 7.37 (d, J=8.08 Hz, 1H), 7.55 (dd, J=8.02, 1.83 Hz, 1H), 7.62 (d, J=1.64 Hz, 1H).
Herkunft & Nachweise
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patentnummer | US09126932B2 |
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| Quelldatensatz | uspto-grants-2015_09 |
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| ORD ID | ord-7e7e5557eb99406693955bf02b719d62 |
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| Quellennotiz | uspto-grants-2015_09 |
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