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CAS No.: | 15931-15-4 |
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Name: | 3-FLUORO-2-METHYLPYRIDINE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C6H6FN |
Molecular Weight: | 111.119 |
Synonyms: | 2-Picoline,3-fluoro- (8CI);3-Fluoro-2-methylpyridine;3-Fluoro-2-picoline; |
Density: | 1.077 g/cm3 |
Boiling Point: | 113.872 °C at 760 mmHg |
Flash Point: | 22.669 °C |
Solubility: | Slightly soluble in water. |
PSA: | 12.89000 |
LogP: | 1.52910 |
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The 3-Fluoro-2-methylpyridine with the CAS number 15931-15-4 is also called Pyridine,3-fluoro-2-methyl-. Its molecular formula is C6H6FN. This chemical belongs to the following product categories: (1)Fluorin-contained pyridine series; (2)Pyridines. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the 3-Fluoro-2-methylpyridine are: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.23; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 5.05; (7)ACD/KOC (pH 5.5): 109.74; (8)ACD/KOC (pH 7.4): 110.89; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.477; (14)Molar Refractivity: 29.16 cm3; (15)Molar Volume: 103.1 cm3; (16)Polarizability: 11.56×10-24cm3; (17)Surface Tension: 32.4 dyne/cm; (18)Enthalpy of Vaporization: 33.78 kJ/mol; (19)Vapour Pressure: 24.2 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccnc1C
(2)InChI: InChI=1/C6H6FN/c1-5-6(7)3-2-4-8-5/h2-4H,1H3
(3)InChIKey: IRIHSZDBTACXCT-UHFFFAOYAN