HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86608890, compound → 2(5H)-Thiophenone, 4-(4-chlorobutoxy)-5-methyl-5-octyl-
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | HCID 86608890 | HCID 86608890 | — |
| Reactant | 4-hydroxy-5-Methyl-5-octylthiophen-2(5H)-one | HCID 135538018 | — |
| Product | 2(5H)-Thiophenone, 4-(4-chlorobutoxy)-5-methyl-5-octyl- | HCID 11439002 | 85% |
Reaction Steps
From 32 (47 mg, 0.18 mmol) and 3-iodo-1-chlorobutane (40 μL, 0.36 mmol) following general procedure H was obtained 41 (46 mg, 85%) after flash chromatography (20% EtOAc/Hexanes). 1H NMR (300 MHz, CDCl3) δ 0.86 (t, J=7 Hz, 3H), 1.07-1.27 (m, 1H), 1.24 (s, 10H) 1.48-1.51 (m, 1H), 1.62 (s, 3H), 1.75-1.82 (m, 2H), 1.89-1.98 (m, 4H), 3.59 (t, J=5.9 Hz, 2H), 3.95-3.98 (m, 2H), 5.28 (s, 1H); 13C NMR (75 MHz, CDCl3) δ 14.1, 22.6, 25.1, 26.0, 26.5, 29.0, 29.2, 29.3, 29.5, 29.7, 31.8, 44.1, 59.6, 71.7, 101.6, 186.1, 193.8. Analysis Calculated for C17H29C2S: C, 61.3; H, 8.78, Found: C, 61.9; H, 9.01.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US07649012B2 |
| Source dataset | uspto-grants-2010_01 |
| ORD ID | ord-0b473234278343f8a9e91cbfdd375a2e |
| Source note | uspto-grants-2010_01 |