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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 22102Generated: October 27, 2026

3-Chloropropionic acid → HCID 178460589, compound

https://huagongshe.com/reaction/22102

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-Chloropropionic acidHCID 7899—
ReactantThiophenolHCID 7969—
Reactantm-BromobenzenethiolHCID 80597—
ReactantSulfurHCID 5362487—
ProductHCID 178460589HCID 178460589—

Reaction Steps

The compounds of this invention in which X is sulfur are available by bromo replacement of the corresponding 2-amino-5-bromothiochromanes. The latter are available by a sequence of reactions beginning with m-bromothiophenol. The thiophenol is treated in base with β-chloropropionic acid to produce m-bromophenylthiopropionic acid. The acid then is cyclized with polyphosphoric acid or with thionyl chloride or phosgene and a Lewis acid to produce a mixture of 5-bromo-4-thiochromanone and 7-bromo-4-thiochromanone. The thiochromanone mixture is reduced using, for example, sodium borohydride, to produce 4-bromo-1,2-benzothiapyran which is then oxidized with an organic peroxide to the corresponding sulfoxide having an epoxy group in the 3,4 position. Upon treatment with a Lewis acid, 5-bromo-3-thiochromanone sulfoxide is formed which can be reduced to the corresponding thiochromanone using dimethyl sulfide in the presence of trifluroacetic anhydride, oxalyl chloride, thionyl chloride, and the like, or reductively aminated to the 3-amino-5-bromothiochromane sulfoxide by treatment with the appropriate amine and sodium borohydride. The latter is reduced to the desired 3-amino-5-bromothiochromane using trifluoroacetic anhydride.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05426229
Source datasetuspto-grants-1995_06
ORD IDord-dd95c1861a014e9d83d9e2a9da955b14
Source noteuspto-grants-1995_06