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5-Fluoro-2-methoxypyridine-3-boronic acid

  • Name 5-Fluoro-2-methoxypyridine-3-boronic acid
  • EINECSN/A
  • CAS No. 957120-32-0
  • Density1.34 g/cm3
  • PSA62.58000
  • LogP-1.09090
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC6H7BFNO3
  • Boiling Point327.6 °C at 760 mmHg
  • Molecular Weight170.936
  • Flash Point151.9 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 957120-32-0 (5-fluoro-2-methoxy-3-pyridineboronic acid)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data2

5-Fluoro-2-methoxypyridine-3-boronic acid Specification

The CAS registry number of 5-Fluoro-2-methoxypyridine-3-boronic acid is 957120-32-0. The IUPAC name is (5-fluoro-2-methoxy-3-pyridyl)boronic acid. In addition, the molecula formula is C6H7BFNO3 and the molecular weight is 170.93. It belongs to the classes of Blocks; BoronicAcids; API Intermediates.

Physical properties about 5-Fluoro-2-methoxypyridine-3-boronic acid are: (1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.23; (4)#H bond acceptors: 4; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 62.58 Å2; (8)Index of Refraction: 1.502; (9)Molar Refractivity: 37.56 cm3; (10)Molar Volume: 127.2 cm3; (11)Polarizability: 14.89 ×10-24cm3; (12)Surface Tension: 47 dyne/cm; (13)Density: 1.34 g/cm3; (14)Flash Point: 151.9 °C; (15)Enthalpy of Vaporization: 60.16 kJ/mol; (16)Boiling Point: 327.6 °C at 760 mmHg; (17)Vapour Pressure: 8.11E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B(c1cc(cnc1OC)F)(O)O
(2)InChI: InChI=1/C6H7BFNO3/c1-12-6-5(7(10)11)2-4(8)3-9-6/h2-3,10-11H,1H3
(3)InChIKey: ASPZNHZSIQDSTM-UHFFFAOYAU

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