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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 468419Generated: October 25, 2026

Ammonia → 3-tert-Butyltoluene

https://huagongshe.com/reaction/468419

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAmmoniaHCID 222—
ReactantLithiumHCID 3028194—
Reactant2-Tert-butyl-4-methylphenyl diethyl phosphateHCID 59129394—
SolventDiethyl EtherHCID 3283—
Product3-tert-ButyltolueneHCID 3371191.1%

Reaction Conditions

Temperature-78 °C

Reaction Steps

To NH3 (liquid, 1000 mL) was added a solution of 2-tert-butyl-4-methylphenyl diethyl phosphate (60 g, crude from last step, about 0.2 mol) in Et2O (anhydrous, 500 mL) at −78° C. under N2 atmosphere. Lithium metal was added to the solution in small pieces until the blue color persisted. The reaction mixture was stirred at −78° C. for 15 min and then was quenched with sat. NH4Cl until the mixture turned colorless. Liquid NH3 was evaporated and the residue was dissolved in water. The mixture was extracted with Et2O (400 mL×2). The combined organics were dried over Na2SO4 and evaporated to give 1-tert-butyl-3-methylbenzene (contaminated with mineral oil) as a colorless oil (27 g, 91%), which was used directly in next step.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08623905B2
Source datasetuspto-grants-2014_01
ORD IDord-53bb1d9f6fae4ce79716c8297dccb547
Source noteuspto-grants-2014_01