HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Methyl-4-[2-(trifluoromethyl)phenyl]benzoic acid → 3-Methyl-4-(4-methylthiophen-3-yl)benzoic acid
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 3-Methyl-4-[2-(trifluoromethyl)phenyl]benzoic acid | HCID 21947812 | — |
| Reactant | Methyl 3-methyl-4-(4-methyl-3-thienyl)benzoate | HCID 58438818 | — |
| Product | 3-Methyl-4-(4-methylthiophen-3-yl)benzoic acid | HCID 57993800 | — |
Reaction Steps
The title compound was prepared following procedure described for Intermediate 5, step 2, but starting from methyl 3-methyl-4-(4-methyl-3-thienyl)benzoate (2.0 g; 8.12 mmol; 1 eq.), affording Intermediate 6 as a beige solid. 1H NMR: (DMSO-d6, 300 MHz) δ 12.97 (s, 1H), 7.91 (s, 1H), 7.84-7.81 (dd, J=8.12 Hz, J=1.87 Hz; 1H), 7.41 (d, J=3.20 Hz, 1H), 7.35-7.34 (m, 1H), 7.28-7.26 (d, J=7.80 Hz, 1H), 2.18 (s, 3H), 2 (s, 3H). LC/MS (Method A): 232.9 (M+H)+; 231.0 (M−H)−. HPLC (max plot) Rt 4.26 min (Purity: 99.6%).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08202865B2 |
| Source dataset | uspto-grants-2012_06 |
| ORD ID | ord-51681b81797742f38064be3093aa6a73 |
| Source note | uspto-grants-2012_06 |