Product Name

  • Name

    2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine

  • EINECS
  • CAS No. 89402-29-9
  • Article Data5
  • CAS DataBase
  • Density 1.786 g/cm3
  • Solubility
  • Melting Point
  • Formula C6H2BrF4N
  • Boiling Point 187.9 °C at 760 mmHg
  • Molecular Weight 243.9843928
  • Flash Point 67.5 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 89402-29-9 (2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine)
  • Hazard Symbols
  • Synonyms 2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine;
  • PSA 12.89000
  • LogP 3.00200

2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine Specification

The CAS register number of 2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine is 89402-29-9. It also can be called as Pyridine,2-bromo-3-fluoro-5-(trifluoromethyl)- and the IUPAC name about this chemical is 2-bromo-3-fluoro-5-(trifluoromethyl)pyridine. The molecular formula about this chemical is C6H2BrF4N and the molecular weight is 243.98.

Physical properties about 2-Bromo-3-fluoro-5-(trifluoromethyl)pyridine are: (1)ACD/LogP: 2.05; (2)ACD/LogD (pH 5.5): 2.05; (3)ACD/LogD (pH 7.4): 2.05; (4)ACD/BCF (pH 5.5): 21.22; (5)ACD/BCF (pH 7.4): 21.22; (6)ACD/KOC (pH 5.5): 309.93; (7)ACD/KOC (pH 7.4): 309.93; (8)#H bond acceptors: 1; (9)Polar Surface Area: 12.89Å2; (10)Index of Refraction: 1.454; (11)Molar Refractivity: 37 cm3; (12)Molar Volume: 136.5 cm3; (13)Polarizability: 14.67x10-24cm3; (14)Surface Tension: 28.7 dyne/cm; (15)Enthalpy of Vaporization: 40.68 kJ/mol; (16)Boiling Point: 187.9 °C at 760 mmHg; (17)Vapour Pressure: 0.848 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(cnc1Br)C(F)(F)F
(2)InChI: InChI=1/C6H2BrF4N/c7-5-4(8)1-3(2-12-5)6(9,10)11/h1-2H
(3)InChIKey: DNVIECHQUYQOOH-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H2BrF4N/c7-5-4(8)1-3(2-12-5)6(9,10)11/h1-2H
(5)Std. InChIKey: DNVIECHQUYQOOH-UHFFFAOYSA-N

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