ChemSpider 2D Image | {3-[2-(Tetrahydro-2H-pyran-2-ylmethoxy)ethoxy]phenyl}boronic acid | C14H21BO5

{3-[2-(Tetrahydro-2H-pyran-2-ylmethoxy)ethoxy]phenyl}boronic acid

  • Molecular FormulaC14H21BO5
  • Average mass280.125 Da
  • Monoisotopic mass280.148193 Da
  • ChemSpider ID39021728

More details:

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

{3-[2-(Tetrahydro-2H-pyran-2-ylmethoxy)ethoxy]phenyl}boronic acid [ACD/IUPAC Name]
{3-[2-(Tetrahydro-2H-pyran-2-ylmethoxy)ethoxy]phenyl}borsäure [German] [ACD/IUPAC Name]
Acide {3-[2-(tétrahydro-2H-pyran-2-ylméthoxy)éthoxy]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[2-[(tetrahydro-2H-pyran-2-yl)methoxy]ethoxy]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: 477.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 242.7±31.5 °C
Index of Refraction: 1.529
Molar Refractivity: 73.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 10.31
ACD/KOC (pH 5.5): 184.69
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.47
ACD/KOC (pH 7.4): 151.71
Polar Surface Area: 68 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 238.3±5.0 cm3

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