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CAS No.: | 5462-66-8 |
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Name: | 4-[2-(4-methoxyphenyl)ethyl]pyridine |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C14H15NO |
Molecular Weight: | 213.279 |
Synonyms: | Pyridine,4-(p-methoxyphenethyl)- (8CI);NSC 13813; |
Density: | 1.065 g/cm3 |
Boiling Point: | 325.9 °C at 760 mmHg |
Flash Point: | 119.4 °C |
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The Pyridine, 4-[2-(4-methoxyphenyl)ethyl]-, with the CAS registry number 5462-66-8, is also known as NSC 13813. This chemical's molecular formula is C14H15NO and molecular weight is 213.28. What's more, its IUPAC name is 4-[2-(4-Methoxyphenyl)ethyl]pyridine.
Physical properties about Pyridine, 4-[2-(4-methoxyphenyl)ethyl]- are: (1)ACD/LogP: 3.12; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 22.12 Å2; (7)Index of Refraction: 1.563; (8)Molar Refractivity: 65.05 cm3; (9)Molar Volume: 200.1 cm3; (10)Polarizability: 25.79×10-24 cm3; (11)Surface Tension: 41 dyne/cm; (12)Density: 1.065 g/cm3; (13)Flash Point: 119.4 °C; (14)Enthalpy of Vaporization: 54.55 kJ/mol; (15)Boiling Point: 325.9 °C at 760 mmHg; (16)Vapour Pressure: 0.000423 mmHg at 25 °C.
Preparation of Pyridine, 4-[2-(4-methoxyphenyl)ethyl]-: this chemical is prepared by 4-(4-Methoxy-trans-styryl)-pyridine. This reaction needs reagent H2, catalyst Pd on activated carbon and solvent Ethanol. The yield is about 63 %.
Uses of Pyridine, 4-[2-(4-methoxyphenyl)ethyl]-: it is used to produce other chemicals. For example, it is used to produce 4-(2-[4]Pyridyl-ethyl)-phenol. The reaction needs reagent Pyridinium chloride. The reaction temperature is 200 °C. The yield is about 85 %.
You can still convert the following datas into molecular structure:
(1) SMILES: O(c1ccc(cc1)CCc2ccncc2)C
(2) InChI: InChI=1/C14H15NO/c1-16-14-6-4-12(5-7-14)2-3-13-8-10-15-11-9-13/h4-11H,2-3H2,1H3
(3) InChIKey: WUOBRCVSGPKAMH-UHFFFAOYAY