ChemSpider 2D Image | (3-Fluoro-4-{[(3-methoxycyclohexyl)oxy]methyl}phenyl)boronic acid | C14H20BFO4

(3-Fluoro-4-{[(3-methoxycyclohexyl)oxy]methyl}phenyl)boronic acid

  • Molecular FormulaC14H20BFO4
  • Average mass282.116 Da
  • Monoisotopic mass282.143860 Da
  • ChemSpider ID44729502

More details:

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

(3-Fluor-4-{[(3-methoxycyclohexyl)oxy]methyl}phenyl)borsäure [German] [ACD/IUPAC Name]
(3-Fluoro-4-{[(3-methoxycyclohexyl)oxy]methyl}phenyl)boronic acid [ACD/IUPAC Name]
Acide (3-fluoro-4-{[(3-méthoxycyclohexyl)oxy]méthyl}phényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-fluoro-4-[[(3-methoxycyclohexyl)oxy]methyl]phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 414.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.3±3.0 kJ/mol
Flash Point: 204.3±31.5 °C
Index of Refraction: 1.517
Molar Refractivity: 71.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.24
ACD/KOC (pH 5.5): 416.82
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 17.26
ACD/KOC (pH 7.4): 223.17
Polar Surface Area: 59 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 42.2±5.0 dyne/cm
Molar Volume: 237.4±5.0 cm3

Click to predict properties on the Chemicalize site


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