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CAS No.: | 4373-67-5 |
---|---|
Name: | 3-(3-METHOXY-PHENYL)-PYRIDINE |
Article Data: | 27 |
Molecular Structure: | |
Formula: | C12H11NO |
Molecular Weight: | 185.225 |
Synonyms: | Pyridine,3-(m-methoxyphenyl)- (7CI,8CI);3-(3-Methoxyphenyl)pyridine; |
Density: | 1.077 g/cm3 |
Boiling Point: | 313.6 °C at 760 mmHg |
Flash Point: | 115 °C |
PSA: | 22.12000 |
LogP: | 2.75720 |
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The 3-(3-Methoxyphenyl)pyridine is an organic compound with the formula C12H11NO. The systematic name of this chemical is 3-(3-methoxyphenyl)pyridine. With the CAS registry number 4373-67-5, it is also named as pyridine, 3-(3-methoxyphenyl)-.
Physical properties about 3-(3-Methoxyphenyl)pyridine are: (1)ACD/LogP: 2.43; (2)ACD/LogD (pH 5.5): 2.37; (3)ACD/LogD (pH 7.4): 2.42; (4)ACD/BCF (pH 5.5): 36.27; (5)ACD/BCF (pH 7.4): 40.97; (6)ACD/KOC (pH 5.5): 439.23; (7)ACD/KOC (pH 7.4): 496.18; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 22.12 Å2; (11)Index of Refraction: 1.56; (12)Molar Refractivity: 55.61 cm3; (13)Molar Volume: 171.9 cm3; (14)Polarizability: 22.04×10-24cm3; (15)Surface Tension: 39.6 dyne/cm; (16)Density: 1.077 g/cm3; (17)Flash Point: 115 °C; (18)Enthalpy of Vaporization: 53.26 kJ/mol; (19)Boiling Point: 313.6 °C at 760 mmHg; (20)Vapour Pressure: 0.000906 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c2cc(c1cccnc1)ccc2)C
(2)InChI: InChI=1/C12H11NO/c1-14-12-6-2-4-10(8-12)11-5-3-7-13-9-11/h2-9H,1H3
(3)InChIKey: HLBOAQSKBNNHMW-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C12H11NO/c1-14-12-6-2-4-10(8-12)11-5-3-7-13-9-11/h2-9H,1H3
(5)Std. InChIKey: HLBOAQSKBNNHMW-UHFFFAOYSA-N