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| CAS No.: | 52818-63-0 |
|---|---|
| Name: | 2-(4-Methoxybenzylamino)pyridine |
| Article Data: | 44 |
| Molecular Structure: | |
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| Formula: | C13H14N2O |
| Molecular Weight: | 214.267 |
| Synonyms: | Pyridine,2-(p-methoxybenzylamino)- (6CI);2-(p-Methoxybenzylamino)pyridine;N-(4-Methoxybenzyl)pyridin-2-amine;N-[(4-Methoxyphenyl)methyl]-2-pyridinamine;NSC 124138;SKF 47437;2-pyridinamine, N-[(4-methoxyphenyl)methyl]-;n-(4-methoxybenzyl)pyridin-2-amine;N2-(4-methoxybenzyl)pyridin-2-amine; |
| EINECS: | 258-202-1 |
| Density: | 1.146 g/cm3 |
| Melting Point: | 121-126 °C |
| Boiling Point: | 362.9 °C at 760 mmHg |
| Flash Point: | 173.3 °C |
| Hazard Symbols: | R36/37/38:Irritating to eyes, respiratory system and skin.; |
| Risk Codes: | Xi:Irritant; ">  Xi:Irritant; |
| Safety: | 24/25 |
| PSA: | 34.15000 |
| LogP: | 2.77530 |
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Specification
The 2-Pyridinamine,N-[(4-methoxyphenyl)methyl]-, with the CAS registry number 52818-63-0, has the systematic name of N-(4-methoxybenzyl)pyridin-2-amine. And the molecular formula of this chemical is C13H14N2O. It is a kind of organics, and should be stored in the dry and cool environment.
The physical properties of 2-Pyridinamine,N-[(4-methoxyphenyl)methyl]- are as following: (1)ACD/LogP: 2.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.85; (4)ACD/LogD (pH 7.4): 2.5; (5)ACD/BCF (pH 5.5): 10.41; (6)ACD/BCF (pH 7.4): 46.22; (7)ACD/KOC (pH 5.5): 120.37; (8)ACD/KOC (pH 7.4): 534.18; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 25.36 Å2; (13)Index of Refraction: 1.614; (14)Molar Refractivity: 65.11 cm3; (15)Molar Volume: 186.8 cm3; (16)Polarizability: 25.81×10-24cm3; (17)Surface Tension: 46.9 dyne/cm; (18)Density: 1.146 g/cm3; (19)Flash Point: 173.3 °C; (20)Enthalpy of Vaporization: 60.89 kJ/mol; (21)Boiling Point: 362.9 °C at 760 mmHg; (22)Vapour Pressure: 1.87E-05 mmHg at 25°C.
Uses of 2-Pyridinamine,N-[(4-methoxyphenyl)methyl]-: It can react with 2-bromo-1-phenyl-ethanone to produce 2-hydroxy-1-(4-methoxy-benzyl)-2-phenyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-4-ylium; bromide. This reaction will need reagent propan-2-ol, and the yield is about 55%.
![2-Pyridinamine,N-[(4-methoxyphenyl)methyl]- can react with 2-bromo-1-phenyl-ethanone to produce 2-hydroxy-1-(4-methoxy-benzyl)-2-phenyl-2,3-dihydro-1H-imidazo[1,2-a]pyridin-4-ylium; bromide](/UserFilesUpload/Uses of 2-Pyridinamine,N-[(4-methoxyphenyl)methyl]-.jpg)
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)CNc2ncccc2)C
(2)InChI: InChI=1/C13H14N2O/c1-16-12-7-5-11(6-8-12)10-15-13-4-2-3-9-14-13/h2-9H,10H2,1H3,(H,14,15)
(3)InChIKey: SMJGJENXFSWIMQ-UHFFFAOYAA