HuagongsheHuagongshe Chemistry Print Report · For research reference only
Trifluoroacetic anhydride → 7-Methylthiochroman-4-one
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Trifluoroacetic anhydride | HCID 9845 | — |
| Reactant | Sodium Carbonate | HCID 10340 | — |
| Reactant | 3-(3-Methylphenylthio)propanoic Acid | HCID 12324927 | — |
| Reactant | Diethylether hexane | HCID 21584099 | — |
| Solvent | Trifluoroacetic acid | HCID 6422 | — |
| Product | 7-Methylthiochroman-4-one | HCID 12324929 | 32% |
Reaction Steps
3-(3-Methylphenylthio)propanoic acid from Step 1 (10.12 g, 52 mmol) was dissolved in trifluoroacetic acid (20 mL), treated with trifluoroacetic anhydride (10 mL) and stirred at room temperature for 1.9 hours. The reaction was poured into 10% Na2CO3 (100 mL), extracted with ether, washed with brine, dried over MgSO4, and concentrated in vacuo to give an orange oil which was passed through a column of silica gel eluting with 8% ether/hexane to give 7-methylthiochroman-4-one (2.97 g, 32%) as a yellow oil: 1H NMR (CDCl3) 300 MHz 7.97 (d, J=8.1 Hz, 1H) 7.06 (s, 1H) 6.97 (d, J=7.7 Hz, 1H) 3.17 (m, 2H) 2.95 (m, 2H) 2.31 (s, 3H). Mass spectrum: M+H=179.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US05547975 |
| Source dataset | uspto-grants-1996_08 |
| ORD ID | ord-463610c0ef4540728c5bce03567eb8b8 |
| Source note | uspto-grants-1996_08 |