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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2104598Generated: October 30, 2026

3-Methyl-3-phenylbutanal → HCID 66913545, compound

https://huagongshe.com/reaction/2104598

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-Methyl-3-phenylbutanalHCID 232459—
ReactantSodium BicarbonateHCID 516892—
ReactantHCID 21555860HCID 21555860—
SolventAcetic AcidHCID 176—
ProductHCID 66913545HCID 6691354533.9%

Reaction Conditions

Temperature200 °C

Reaction Steps

3,3-Dimethyl-3-phenylpropionaldehyde (0.272 g, 1.67 mmol) and [2-amino-3-(trifluoromethyl)phenyl](phenyl)methanone (0.138 g, 0.52 mmol) are dissolved in AcOH (3 mL) and treated with 1:20H2SO4/AcOH solution (0.10 mL). The mixture is heated in a microwave at 175° C. for 15 min and a further 5 min at 200° C. The reaction is carefully poured into saturated aq sodium bicarbonate and extracted with ethyl acetate. The extracts are washed with saturated aq sodium bicarbonate and dried (MgSO4). The product is chromatographed eluting with 5:95 ethyl acetate:hexane. The partially purified is further purified using Prep HPLC with a gradient of 10-100% acetonitrile/water to afford the title compound (0.069 g). HRMS: calcd for C25H20F3N+H, 392.16261; found (ESI, [M+H]+), 392.1637.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07576215B2
Source datasetuspto-grants-2009_08
ORD IDord-dd24f2da829a4b6ab0b0b2e6f5b5e74b
Source noteuspto-grants-2009_08