CAS No.128071-79-4,2-Fluoro-4-Bromo-3-Picoline Suppliers

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Basic Information

Molecular Structure:
CAS No.:	128071-79-4
Name:	2-Fluoro-4-Bromo-3-Picoline
Article Data:	3

Formula:	C₆H₅BrFN
Molecular Weight:	190.015
Synonyms:	bromo-4 fluoro-2 methyl-3 pyridine;4-Bromo-2-fluoro-3-methyl-pyridine;4-Bromo-2-fluoro--3-picoline;2-Fluoro-4-bromo-3-methylpyridine;
Density:	1.592g/cm³
Boiling Point:	220.2 °C at 760 mmHg
Flash Point:	87 °C
PSA:	12.89000
LogP:	2.29160

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Specification

The 4-Bromo-2-fluoro-3-methylpyridine, with CAS registry number 128071-79-4, has the systematic name of 4-bromo-2-fluoro-3-methylpyridine. This chemical belongs to the following product category: Pyridine. Besides this, it is also called 2-Fluoro-4-Bromo-3-Picoline. And the chemical formula of this chemical is C₆H₅BrFN.

Physical properties of 4-Bromo-2-fluoro-3-methylpyridine: (1)ACD/LogP: 2.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.1; (4)ACD/LogD (pH 7.4): 2.1; (5)ACD/BCF (pH 5.5): 23.31; (6)ACD/BCF (pH 7.4): 23.31; (7)ACD/KOC (pH 5.5): 331.47; (8)ACD/KOC (pH 7.4): 331.47; (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: 1.529; (14)Molar Refractivity: 36.85 cm³; (15)Molar Volume: 119.3 cm³; (16)Polarizability: 14.6×10^-24cm³; (17)Surface Tension: 38.2 dyne/cm; (18)Density: 1.592 g/cm³; (19)Flash Point: 87 °C; (20)Enthalpy of Vaporization: 43.8 kJ/mol; (21)Boiling Point: 220.2 °C at 760 mmHg; (22)Vapour Pressure: 0.17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccnc(F)c1C
(2)InChI: InChI=1/C6H5BrFN/c1-4-5(7)2-3-9-6(4)8/h2-3H,1H3
(3)InChIKey: YRLGBXZZABNBNL-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H5BrFN/c1-4-5(7)2-3-9-6(4)8/h2-3H,1H3
(5)Std. InChIKey: YRLGBXZZABNBNL-UHFFFAOYSA-N