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ChemicalBook--->CAS DataBase List--->13104-56-8

13104-56-8

13104-56-8 Structure

13104-56-8 Structure
IdentificationBack Directory
[Name]

4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE
[CAS]

13104-56-8
[Synonyms]

4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE
2,6-Di[2-pyridyl-4-(p-methoxyphenyl)pyridine
4'-(p-Methoxyphenyl)-2,2':6',2''-terpyridine
2,2':6',2''-Terpyridine, 4'-(4-methoxyphenyl)-
4-(4-methoxyphenyl)-2,6-dipyridin-2-ylpyridine
2,6-Di(2-pyridinyl)-4-(4-methoxyphenyl)pyridine
[Molecular Formula]

C22H17N3O
[MDL Number]

MFCD06796987
[MOL File]

13104-56-8.mol
[Molecular Weight]

339.39
Chemical PropertiesBack Directory
[Melting point ]

167-168℃
[Boiling point ]

504.5±50.0 °C(Predicted)
[density ]

1.174±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

4.62±0.22(Predicted)
[Appearance]

White to off-white Solid
[Water Solubility ]

Insoluble in water.
[CAS DataBase Reference]

13104-56-8
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard InformationBack Directory
[Uses]

4'-(4-Methoxyphenyl)-2,2':6',2''-terpyridine is used as an organic chemical synthesis intermediate.
[Synthesis]

2-Acetylpyridine

1122-62-9

p-Anisaldehyde

123-11-5

4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE

13104-56-8

Generic method: 4'-(3-methoxyphenyl)-2,2':6',2"-terpyridine (3-MeO-Phtpy), 4'-(2-methoxyphenyl)-2,2':6',2"-terpyridine (2-MeO-Phtpy) and 4'-(4-methoxyphenyl)-2,2':6',2"-terpyridine (4-MeO-Phtpy) The synthesis was carried out with reference to the method described in the literature [27-33]. The steps were as follows: 2-acetylpyridine (2.813 g, 23.2 mmol, 2 eq.) was added to a 50 mL ethanol solution dissolved in 2-methoxybenzaldehyde, 3-methoxybenzaldehyde or 4-methoxybenzaldehyde (11.6 mmol, 1 eq.). Subsequently, KOH pellets (46.5 mmol, 4 eq.) were added to this solution. The reaction mixture was stirred at room temperature for 10 minutes. NH3 (40 mL, 25% aqueous solution) was slowly added to the reaction mixture. After incubation at 37 °C for 24 h, 5 mL of 25% aqueous NH3 was added. The reaction mixture was cooled to -20 °C and the resulting white precipitate was separated by filtration and washed with cold ethanol. For further purification of each product, recrystallization was carried out using ethanol-H2O mixed solvent. After recrystallization, each product was recovered by filtration, washed sequentially with cold ethanol and petroleum ether, and finally dried under high vacuum for 24 h (Scheme 1).

[References]

[1] Applied Organometallic Chemistry, 2017, vol. 31, # 10,
[2] Applied Organometallic Chemistry, 2017, vol. 31, # 6,
[3] Chemistry - An Asian Journal, 2018, vol. 13, # 21, p. 3169 - 3172
[4] Chemistry Letters, 2005, vol. 34, # 5, p. 732 - 733
[5] Synthesis, 2005, # 18, p. 3045 - 3050
Spectrum DetailBack Directory
[Spectrum Detail]

4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE(13104-56-8)MS
4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE(13104-56-8)1HNMR
4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE(13104-56-8)13CNMR
4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE(13104-56-8)IR1
4'-(4-METHOXYPHENYL)-2,2':6',2''-TERPYRIDINE(13104-56-8)IR2
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