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CAS No.: | 180608-37-1 |
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Name: | 2-Bromo-6-Fluoro-4-Picoline |
Molecular Structure: | |
Formula: | C6H5BrFN |
Molecular Weight: | 190.015 |
Synonyms: | 2-Bromo-6-fluoro-4-methylpyridine;2-Bromo-6-Fluoro-4-Picoline; |
Density: | 1.592 g/cm3 |
Boiling Point: | 230.828 °C at 760 mmHg |
Flash Point: | 93.402 °C |
Solubility: | Slightly soluble in water. |
PSA: | 12.89000 |
LogP: | 2.29160 |
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The CAS register number of Pyridine,2-bromo-6-fluoro-4-methyl- is 180608-37-1. It also can be called as 2-Bromo-6-Fluoro-4-Picoline and the systematic name about this chemical is 2-bromo-6-fluoro-4-methyl-pyridine. The molecular formula about this chemical is C6H5BrFN and the molecular weight is 190.0130032. It belongs to the following product categorie which include Pyridine.
Physical properties about Pyridine,2-bromo-6-fluoro-4-methyl- are: (1)ACD/LogP: 2.08; (2)ACD/LogD (pH 5.5): 2.079; (3)ACD/LogD (pH 7.4): 2.079; (4)ACD/BCF (pH 5.5): 22.404; (5)ACD/BCF (pH 7.4): 22.404; (6)ACD/KOC (pH 5.5): 322.238; (7)ACD/KOC (pH 7.4): 322.238; (8)#H bond acceptors: 1 ; (9)Polar Surface Area: 12.89 Å2; (10)Index of Refraction: 1.53; (11)Molar Refractivity: 36.853 cm3; (12)Molar Volume: 119.327 cm3; (13)Polarizability: 14.61x10-24cm3; (14)Surface Tension: 38.216 dyne/cm; (15)Density: 1.592 g/cm3; (16)Flash Point: 93.402 °C; (17)Enthalpy of Vaporization: 44.848 kJ/mol; (18)Boiling Point: 230.828 °C at 760 mmHg; (19)Vapour Pressure: 0.098 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(nc(c1)Br)F
(2)InChI: InChI=1/C6H5BrFN/c1-4-2-5(7)9-6(8)3-4/h2-3H,1H3
(3)InChIKey: CIDWWTCSJWQJQR-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C6H5BrFN/c1-4-2-5(7)9-6(8)3-4/h2-3H,1H3
(5)Std. InChIKey: CIDWWTCSJWQJQR-UHFFFAOYSA-N