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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2117550Generated: October 31, 2026

Acetic Acid → HCID 69293416, compound

https://huagongshe.com/reaction/2117550

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantTrifluoroacetic acidHCID 6422—
ReactantSodium HydroxideHCID 14798—
ReactantHCID 54043815HCID 54043815—
SolventWaterHCID 962—
SolventEthyl AcetateHCID 8857—
ProductHCID 69293416HCID 69293416—

Reaction Steps

The title compound was prepared following the method described in Example 3, Step C from (3-{[benzenesulfonyl-(4-pyridin-2-yl-benzyl)-amino]-methyl}-phenoxy)-acetic acid tert-butyl ester of Step B. The TFA salt was diluted with EtOAc and water and the aqueous solution was basified to about pH 11 with NaOH (1N). The aqueous solution was acidified with glacial acetic acid to about pH 5 and was washed with EtOAc (3×). The organic solution was dried (MgSO4), filtered, and concentrated, azeotroping with toluene, to provide the free acid (128 mg). The acid was dissolved in a mixture of acetone (4 mL), MeOH (4 mL) and water (0.5 mL), and NaHCO3 (22 mg, 0.258 mmol) was added. The reaction was stirred for 24 h and was concentrated in vacuo, azeotroping with EtOH (3×) and CHCl3 (1×) to provide the title sodium salt (137 mg). 1H NMR (400 MHz, CD3OD) δ 8.56 (dd, 1H), 7.89-7.76 (m, 6H), 7.65-7.56 (m, 3H), 7.33 (m, 1H), 7.21 (d, 2H), 7.05 (t, 1H), 6.74 (d, 1H), 6.63 (m, 2H), 4.40 (s, 2H), 4.31 (s, 2H), 4.21 (s, 2H); MS 487 (M−1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07442702B2
Source datasetuspto-grants-2008_10
ORD IDord-c048ef9b143747009603f4204d032505
Source noteuspto-grants-2008_10