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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 505941Generated: November 3, 2026

Water → HCID 72961919, compound

https://huagongshe.com/reaction/505941

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantAcetonitrileHCID 6342—
ReactantTrifluoroacetic acidHCID 6422—
ReactantHCID 68628015HCID 68628015—
ProductHCID 72961919HCID 72961919—

Reaction Steps

The titled compound (60) was prepared according to the procedures described in Step 4 of Example 1, by using 3-[2-(benzylamino-methyl)-1-methyl-1H-bezimidazol-5-yl]-acrylic acid methyl ester as the starting material HPLC: 89.6%; tR=(LC/PDA: Phenomenex Luna C18 2.0×150 mm 5μ column; 0.8 mL/min, gradient 5-65% B over 15.5 min, Solvent A: H2O with 0.1% trifluoroacetic acid; Solvent B: Acetonitrile with 0.1% trifluoroacetic acid; UV 254): 3.68 min. 1H NMR (400 MHz, DMSO-d6) δ 3.78(3H, s), 4.37 (2H, s), 4.58 (2H, s), 6.48 (1H,d), 7.46 (3H, m), 7.55 (3H, m) 7.64 (2H, t) 7.88 (1H, s), 9.88 (1H, bs), 10.74 (1H, bs). MS (m/z): 337 [MH]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07781595B2
Source datasetuspto-grants-2010_08
ORD IDord-1bf80dd49d2940418b38a2ce80060c4f
Source noteuspto-grants-2010_08