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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1062823Generated: October 25, 2026

Acetic Acid → 1,1-Dimethylethyl 6-cyano-3,5-dihydroxyhexanoate

https://huagongshe.com/reaction/1062823

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantSodium HydroxideHCID 14798—
ReactantSodium borohydrideHCID 4311764—
ReactantTert-butyl 6-cyano-5-hydroxy-3-oxohexanoateHCID 11637184—
SolventMethanolHCID 887—
SolventTetrahydrofuranHCID 8028—
Product1,1-Dimethylethyl 6-cyano-3,5-dihydroxyhexanoateHCID 22282997—

Reaction Steps

Crude 5R 1,1-dimethylethyl 6-cyano-5-hydroxy-3-oxohexanoate (about 150 moles) from Step (1) is dissolved in the first distillate from Step (a) along with 50 L of tetrahydrofuran, cooled to −75° C.±20° C., and optionally diluted with 25 L of methanol, and 10 kg of acetic acid. Sodium borohydride (8 kg) as a solution in methanol and aqueous sodium hydroxide is added slowly. After the addition, the reaction mixture is warmed to 0° C.±25° C. The reaction mixture is quenched by the addition of 10 kg of acetic acid and 20 L of methanol and concentrated by vacuum distillation. The residue is dissolved in methanol and acetic acid, optionally diluted with water, and concentrated by vacuum distillation. The residue is dissolved in methanol and concentrated by vacuum distillation. The residue is dissolved in a mixture of water and ethyl acetate, and the aqueous layer separated. The organic layer is concentrated by vacuum distillation. The residue is dissolved in methanol and acetic acid and concentrated by vacuum distillation. The residue is dissolved in ethyl acetate and concentrated by vacuum distillation affording crude [R—(R*,R*)]-1,1-dimethylethyl 6-cyano-3,5-dihydroxyhexanoate.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06962994B2
Source datasetuspto-grants-2005_11
ORD IDord-ba9292c309024c0ebdb0fd1057be15e0
Source noteuspto-grants-2005_11