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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 627992Generated: October 29, 2026

Sodium Hydroxide → 5-(8-bromo-4,5-dihydrobenzo[b]thieno[2,3-d]oxepin-2-yl)-1-(2-chlorophenyl)-1H-tetrazole

https://huagongshe.com/reaction/627992

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium HydroxideHCID 14798—
ReactantSodium NitriteHCID 23668193—
ReactantHCID 178514378HCID 178514378—
SolventAcetic AcidHCID 176—
SolventWaterHCID 962—
Product5-(8-bromo-4,5-dihydrobenzo[b]thieno[2,3-d]oxepin-2-yl)-1-(2-chlorophenyl)-1H-tetrazoleHCID 5790025472.3%

Reaction Steps

A solution of crude 8-bromo-N-(2-chlorophenyl)-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carbohydrazonamide (150 mg, 0.334 mmol) in acetic acid (0.5 mL) was treated with a solution of sodium nitrite (115 mg, 1.6 mmol) in water (0.5 mL) at 0° C. After 30 min, an additional 50 mg of sodium nitrite was added. After 10 min, 3 mL of 10% aqueous sodium hydroxide was added. The mixture was extracted with ethyl acetate and the organics dried over sodium sulfate and concentrated. The crude residue was purified by flash column chromatography to give 286 as a colorless solid (111 mg). 1H NMR (dmso-d6, 400 MHz) δ 8.00 (m, 1H), 7.98 (m, 1H), 7.85 (m, 1H), 7.56 (m, 1H), 7.46 (m, 1H), 7.26 (m, 2H), 7.13 (m, 1H), 4.27 (t, 2H), 3.11 (t, 2H). MS (ESI) 461.1

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09309265B2
Source datasetuspto-grants-2016_04
ORD IDord-f5ac7cac7645418a94f8b453d3653547
Source noteuspto-grants-2016_04