ChemicalBook--->CAS DataBase List--->883-39-6

883-39-6

883-39-6 Structure

883-39-6 Structure
IdentificationBack Directory
[Name]

1-Phenyl-1H-benzotriazole
[CAS]

883-39-6
[Synonyms]

1-phenylbenzotriazole
1-Phenyl-1H-benzotriazole
1H-Benzotriazole, 1-phenyl-
1-Phenyl-1H-benzo[d][1,2,3]triazole
[Molecular Formula]

C12H9N3
[MDL Number]

MFCD01924397
[MOL File]

883-39-6.mol
[Molecular Weight]

195.22
Chemical PropertiesBack Directory
[Melting point ]

108-109 °C
[Boiling point ]

359.3±25.0 °C(Predicted)
[density ]

1.21±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

0.82±0.30(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

1-Phenyl-1H-benzo[d][1,2,3]triazole is a reagent used in the prepartion of possible surrogates for kobayashi’s aryne precursors.
[Synthesis]

1H-Benzotriazole

95-14-7

Iodobenzene

591-50-4

1-Phenyl-1H-benzotriazole

883-39-6

GENERAL METHODS: Cu(OAc)2-H2O (0.01 mmol) was dissolved in DMF (2 mL) under nitrogen protection, and iodobenzene (1.2 mmol), benzotriazole (1.0 mmol), and Cs2CO3 (2 mmol) were added sequentially. The reaction system was stirred at 110 °C for 24 hours. After completion of the reaction, it was cooled to room temperature and the reaction mixture was partitioned between water and ethyl acetate. The organic phase was separated and the aqueous phase was extracted with ethyl acetate. The organic phases were combined, washed with saturated brine, dried over anhydrous Na2SO4 and concentrated under reduced pressure. The residue was purified by silica gel column chromatography to afford the target product 1-phenyl-1H-benzo[d][1,2,3]triazole.

[References]

[1] Tetrahedron Letters, 1998, vol. 39, # 31, p. 5617 - 5620
[2] RSC Advances, 2015, vol. 5, # 51, p. 40628 - 40635
[3] Synthetic Communications, 2012, vol. 42, # 15, p. 2217 - 2228
[4] Journal of Organic Chemistry, 2004, vol. 69, # 17, p. 5578 - 5587
[5] Synthesis, 2012, vol. 44, # 7, p. 1063 - 1068
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