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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2102230Generated: October 31, 2026

1-Hydroxybenzotriazole → HCID 178522664, compound

https://huagongshe.com/reaction/2102230

Reaction equation

Participants

RoleNameHCIDCharge
Reactant1-HydroxybenzotriazoleHCID 75771—
ReactantDiisopropylethylamineHCID 81531—
ReactantHCID 67334871HCID 67334871—
ReactantHCID 178509300HCID 178509300—
Solvent1,2-DichloroethaneHCID 11—
SolventDimethyl SulfoxideHCID 679—
SolventWaterHCID 962—
SolventDimethylformamideHCID 6228—
SolventAcetonitrileHCID 6342—
ProductHCID 178522664HCID 178522664—

Reaction Steps

A mixture of 66.7 mg product from Step F above, 71.9 mg EDC, 30.4 mg HOBt and 23.2 mg aminotetrazole monohydrate was dissolved in 1 mL DMF. DIEA (92 μL) was added immediately and the resulting solution was stirred at room temperature for 17 hours. The reaction mixture was diluted with a mixture of DMSO, MeCN, and water and purified on preparative HPLC using 65˜80% MeCN gradient over 10 minutes at 8.0 mL per minute with 0.1% TFA. The title compound was obtained as a white solid following lyophilization. 1H NMR (DMSO-d6, 500 MHz) δ 8.045 (d, J=8.2 Hz, 2H), 7.50˜7.54 (m, 4H), 7.41 (d, J=8.2 Hz, 2H), 7.33 (s, 1H), 4.06 (s, 2H), 2.64 (tt, J=3.0 & 12.2 Hz, 1H), 1.62˜1.72 (m, 4H), 1.48˜1.48 (m, 3H), 1.05˜1.15 (m, 3H). LC-MS: 1.97 min. (M+H=512.2).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07572922B2
Source datasetuspto-grants-2009_08
ORD IDord-bac9d64912a7454ca7fcc83d41e2fb09
Source noteuspto-grants-2009_08