CAS No.222551-24-8,2-(4-FLUORO-PHENYL)-4-METHYL-PYRIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	222551-24-8
Name:	2-(4-FLUORO-PHENYL)-4-METHYL-PYRIDINE
Article Data:	7

Formula:	C₁₂H₁₀FN
Molecular Weight:	187.217
Synonyms:	2-(4-Fluorophenyl)-4-methylpyridine;
Density:	1.112 g/cm³
Boiling Point:	282.436 °C at 760 mmHg
Flash Point:	124.613 °C
PSA:	12.89000
LogP:	3.19610

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Specification

The Pyridine, 2-(4-fluorophenyl)-4-methyl- has CAS registry number 222551-24-8. This chemical's molecular formula is C₁₂H₁₀FN and molecular weight is 187.21. What's more, its systematic name is 2-(4-Fluorophenyl)-4-methylpyridine.

Physical properties about Pyridine, 2-(4-fluorophenyl)-4-methyl- are: (1)ACD/LogP: 3.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 82; (6)ACD/BCF (pH 7.4): 116; (7)ACD/KOC (pH 5.5): 738; (8)ACD/KOC (pH 7.4): 1046; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 53.755 cm³; (15)Molar Volume: 168.427 cm³; (16)Polarizability: 21.31×10^-24 cm³; (17)Surface Tension: 38.502 dyne/cm; (18)Density: 1.112 g/cm³; (19)Flash Point: 124.613 °C; (20)Enthalpy of Vaporization: 50.036 kJ/mol; (21)Boiling Point: 282.436 °C at 760 mmHg; (22)Vapour Pressure: 0.006 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc2ccc(c1nccc(c1)C)cc2
(2) InChI: InChI=1/C12H10FN/c1-9-6-7-14-12(8-9)10-2-4-11(13)5-3-10/h2-8H,1H3
(3) InChIKey: LNUBZXLVNZUZTH-UHFFFAOYAB