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5216-04-6

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Basic Information
CAS No.: 5216-04-6
Name: 3,4-DIPHENYLPYRIDINE
Article Data: 8
Molecular Structure:
Molecular Structure of 5216-04-6 (3,4-DIPHENYLPYRIDINE)
Formula: C17H13N
Molecular Weight: 231.297
Synonyms: 3,4-diphenylpyridine;
Density: 1.084 g/cm3
Boiling Point: 345.3 °C at 760 mmHg
Flash Point: 147.4 °C
PSA: 12.89000
LogP: 4.41560
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  • 3,4-DIPHENYLPYRIDINE

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    3,4-DIPHENYLPYRIDINE

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Specification

The Pyridine, 3,4-diphenyl-, with the CAS registry number 5216-04-6, has molecular formula C17H13N. In addition, this chemical's molecular weight is 231.29. Its systematic name is called 3,4-diphenylpyridine.

Physical properties of Pyridine, 3,4-diphenyl-: (1)ACD/LogP: 4.07; (2)ACD/LogD (pH 5.5): 3.94; (3)ACD/LogD (pH 7.4): 4.06; (4)ACD/BCF (pH 5.5): 544.3; (5)ACD/BCF (pH 7.4): 720.49; (6)ACD/KOC (pH 5.5): 2916.05; (7)ACD/KOC (pH 7.4): 3859.93; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.605; (11)Molar Refractivity: 73.52 cm3; (12)Molar Volume: 213.2 cm3; (13)Surface Tension: 43.6 dyne/cm; (14)Density: 1.084 g/cm3; (15)Flash Point: 147.4 °C; (16)Enthalpy of Vaporization: 56.61 kJ/mol; (17)Boiling Point: 345.3 °C at 760 mmHg; (18)Vapour Pressure: 0.000124 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n2ccc(c(c1ccccc1)c2)c3ccccc3
(2)InChI: InChI=1/C17H13N/c1-3-7-14(8-4-1)16-11-12-18-13-17(16)15-9-5-2-6-10-15/h1-13H
(3)InChIKey: WTWBOYYHZXYFER-UHFFFAOYAO