Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Sulfuric Acid | HCID 1118 | — |
| Reactant | 3-Benzoylbenzoic acid | HCID 101386 | — |
| Product | Ethyl 3-benzoylbenzoate | HCID 14789261 | — |
Reaction Steps
A 100-mL round bottom flask was charged with of 3-benzoylbenzoic acid (2.20 g, 9.7 mmol), ethanol (40 mL), and sulfuric acid (3 mL). The reaction mixture was heated at 100° C. for 15 h, poured into ice water and extracted twice with Et2O. The combined organic phase was washed with satd aq NaHCO3 and dried over K2CO3. The crude ethyl 3-benzoylbenzoate was used in the next step without further purification. LC-MS (3 min) tR=1.87 min in 3 min chromatography, m/z 255 (MH+). 1H NMR (400 MHz, CDCl3) δ 8.45-8.44 (m, 1H), 8.28-8.25 (m, 1H), 8.00-7.97 (m, 1H), 7.82-7.79 (m, 2H), 7.64-7.48 (m, 4H), 4.40 (q, J=7.1 Hz, 2H), 1.40 (t, J=7.2 Hz, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US08455521B2 |
|---|
| Source dataset | uspto-grants-2013_06 |
|---|
| ORD ID | ord-00536539583a483481ba6bd54e701f4a |
|---|
| Source note | uspto-grants-2013_06 |
|---|