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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1604095Generated: November 1, 2026

Acetic Acid → HCID 9929531, compound

https://huagongshe.com/reaction/1604095

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantIsobutyl nitrateHCID 10974—
ReactantHCID 11142115HCID 11142115—
ReactantPotassium tert-butoxideHCID 23665647—
SolventDichloromethaneHCID 6344—
Solventtert-ButanolHCID 6386—
ProductHCID 9929531HCID 9929531—

Reaction Steps

Potassium tert-butoxide (7.6 g, 67.8 mM), (20S)-20-hydroxymethylpregn-4-en-3-one (6.6 g, 20 mM) in tert-butanol is heated at reflux temperature for 60 minutes under an argon atmosphere. Isobutylnitrate (2.34 ml, 20 mM) is then added in one continuous portion. After 20 minutes of further refluxing, the reaction vessel is cooled to room temperature. Acetic acid (10 ml) is then added, and the reaction vessel stirred for 18 hours, after which the combination is diluted with dichloromethane (200 mL). The solids are removed, washed, and recombined with the washing residue and subsequently purified as described in Example 1 to give crystallized (20S)-20-hydroxymethyl-4-nitropregn-4-en-3-one.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05990328
Source datasetuspto-grants-1999_11
ORD IDord-0b56052df310461fb9fe7a0161a09c93
Source noteuspto-grants-1999_11