HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 4-(4-{[(3,5-Dimethylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)benzoate → 4-(4-{[(3,5-Dimethylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)benzoic Acid
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Methyl 4-(4-{[(3,5-Dimethylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)benzoate | HCID 68278472 | — |
| Solvent | Hydrochloric Acid | HCID 313 | — |
| Product | 4-(4-{[(3,5-Dimethylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)benzoic Acid | HCID 68278369 | 100% |
Reaction Steps
Reaction of benzoate 25 (346 mg, 0.87 mmol) and 6 M HCl (10 mL) gave acid 26 (335 mg, 100%) as a white solid: mp (H2O) 265-268° C.; 1H NMR δ 13.16 (br s, 1H, CO2H), 8.05 (dd, J=8.5, 1.8 Hz, 2H, H-2, H-6), 7.93 (ddd, J=8.5, 1.8 Hz, 2H, H-3, H-5), 7.41 (br s, 2H, H-2′, H-6′), 7.37 (br s, 1H, H-4′), 4.62 (s, 2H, CH2SO2), 2.32 (s, 6H, 2×CH3), 2.19 (s, 3H, CH3); MS m/z 386.5 MH+, 100%). Anal. calcd for C20H19NO5S: C, 62.32; H, 4.97; N, 3.63. Found: C, 62.59; H, 4.84; N, 3.58%.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09296732B2 |
| Source dataset | uspto-grants-2016_03 |
| ORD ID | ord-94c08edb2c1e429cae9508efe24836c8 |
| Source note | uspto-grants-2016_03 |