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2217657-09-3

2217657-09-3 Structure

2217657-09-3 Structure
IdentificationBack Directory
[Name]

3-chloro-1-(1,1-dimethylethyl)Naphthalene
[CAS]

2217657-09-3
[Synonyms]

1-(tert-butyl)-3-chloronaphthalene
3-chloro-1-(1,1-dimethylethyl)Naphthalene
[Molecular Formula]

C14H15Cl
[MOL File]

2217657-09-3.mol
[Molecular Weight]

218.72
Chemical PropertiesBack Directory
[Boiling point ]

300.1±11.0 °C(Predicted)
[density ]

1.081±0.06 g/cm3(Predicted)
[InChI]

InChI=1S/C14H15Cl/c1-14(2,3)13-9-11(15)8-10-6-4-5-7-12(10)13/h4-9H,1-3H3
[InChIKey]

ALECXKNDPPUBFP-UHFFFAOYSA-N
[SMILES]

C1(C(C)(C)C)=C2C(C=CC=C2)=CC(Cl)=C1
Hazard InformationBack Directory
[Uses]

3-chloro-1-(1,1-dimethylethyl)Naphthalene, also known as 1-(tert-butyl)-3-chloronaphthalene, is a key intermediate in the synthesis process of organic electroluminescent diodes (OLED) molecular materials.
[Preparation]

In a three-neck flask, the catalyst ligand 1-(2-carboxyethyl)-3-formyltriacyl-1H-imidazol-3-ammonium chloride (1.03 mmol), nickel acetylacetonate (1.01 mmol), and lithium tert-butoxide (31.2 mmol) were added to tetrahydrofuran (100 mL). Isopropyl magnesium chloride (14.6 mL, 1.7 M ether solution, 24.8 mmol) was subsequently added under nitrogen protection and agitation. Add 1-bromo-3-chloronaphthalene after 0.5 h and stir at 0 °C for 2 h. Finally, 3-chloro-1-(1,1-dimethylethyl)Naphthalene was obtained after purification.
3-chloro-1-(1,1-dimethylethyl)Naphthalene
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