ChemSpider 2D Image | (2-Fluoro-4-{[3-(3-methoxypropoxy)-1-azetidinyl]carbonyl}phenyl)boronic acid | C14H19BFNO5

(2-Fluoro-4-{[3-(3-methoxypropoxy)-1-azetidinyl]carbonyl}phenyl)boronic acid

  • Molecular FormulaC14H19BFNO5
  • Average mass311.114 Da
  • Monoisotopic mass311.134033 Da
  • ChemSpider ID72896643

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2-Fluor-4-{[3-(3-methoxypropoxy)-1-azetidinyl]carbonyl}phenyl)borsäure [German] [ACD/IUPAC Name]
(2-Fluoro-4-{[3-(3-methoxypropoxy)-1-azetidinyl]carbonyl}phenyl)boronic acid [ACD/IUPAC Name]
Acide (2-fluoro-4-{[3-(3-méthoxypropoxy)-1-azétidinyl]carbonyl}phényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[2-fluoro-4-[[3-(3-methoxypropoxy)-1-azetidinyl]carbonyl]phenyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 512.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 263.7±32.9 °C
Index of Refraction: 1.545
Molar Refractivity: 75.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.30
ACD/LogD (pH 5.5): 0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.11
ACD/LogD (pH 7.4): 0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.70
Polar Surface Area: 79 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 240.1±5.0 cm3

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