HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1591557Generated: November 1, 2026
(4-Mercapto-5-methoxy-2-methyl-phenoxy)-acetic Acid Methyl Ester → {5-Methoxy-2-methyl-4-[5-(4-trifluoromethyl-phenyl)-isoxazol-3-ylmethylsulfanyl]-phenoxy}-acetic acid
https://huagongshe.com/reaction/1591557
Participants
| Role | Name | HCID | Charge |
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| Reactant | (4-Mercapto-5-methoxy-2-methyl-phenoxy)-acetic Acid Methyl Ester | HCID 11311052 | — |
| Reactant | 3-(Chloromethyl)-5-[4-(trifluoromethyl)phenyl]isoxazole | HCID 22064260 | — |
| Solvent | Acetic Acid | HCID 176 | — |
| Product | {5-Methoxy-2-methyl-4-[5-(4-trifluoromethyl-phenyl)-isoxazol-3-ylmethylsulfanyl]-phenoxy}-acetic acid | HCID 10310542 | — |
Reaction Steps
Preparation of {5-Methoxy-2-methyl-4-[5-(4-trifluoromethyl-phenyl)-isoxazol-3-ylmethylsulfanyl]-phenoxy}-acetic acid methyl ester (compound 43A) The title compound was prepared in a manner analogous to Example 1F using 42C and 1D. MS m/z 468 (M+1). Step 2. Preparation of {5-Methoxy-2-methyl-4-15-(4-trifluoromethyl-phenyl)-isoxazol-3-ylmethylsulfanyl]-phenoxy}-acetic acid (compound 43) The title compound was prepared in a manner analogous to Example 1 using 43A. IR cm−1: 1745, 1322; 400 MHz 1H NMR (DMSO-d6) δ 12.96 (br(s), 1H), 8.01 (d, 2H, J=8.3 Hz), 7.83 (d, 2H, J=8.3 Hz), 7.07 (s, 2H), 6.52 (s, 1H), 4.70 (s, 2H), 4.03 (s, 2H), 3.71 (s, 3H), 1.99 (s, 3H); MS m/z 454 (M+1). Anal. Calc'd for C21H18F3NO3S. 0.1H2O C, 54.46; H, 3.92; N, 3.01 found: C, 54.54; H, 3.74; N, 2.93.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | USRE039916E1 |
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| Source dataset | uspto-grants-2007_11 |
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| ORD ID | ord-be41a9bf727a44dd8d30e37c47e37def |
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| Source note | uspto-grants-2007_11 |
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