ChemSpider 2D Image | (R)-3-(benzyloxy)-2,2-difluorobutane-1,4-diol | C11H14F2O3

(R)-3-(benzyloxy)-2,2-difluorobutane-1,4-diol

  • Molecular FormulaC11H14F2O3
  • Average mass232.224 Da
  • Monoisotopic mass232.091095 Da
  • ChemSpider ID24775930

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-(Benzyloxy)-2,2-difluor-1,4-butandiol [German] [ACD/IUPAC Name]
(3R)-3-(Benzyloxy)-2,2-difluoro-1,4-butanediol [ACD/IUPAC Name]
(3R)-3-(Benzyloxy)-2,2-difluoro-1,4-butanediol [French] [ACD/IUPAC Name]
(R)-3-(benzyloxy)-2,2-difluorobutane-1,4-diol
1,4-Butanediol, 2,2-difluoro-3-(phenylmethoxy)-, (3R)- [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: 396.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 180.1±23.0 °C
Index of Refraction: 1.506
Molar Refractivity: 54.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.21
ACD/KOC (pH 5.5): 196.35
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.21
ACD/KOC (pH 7.4): 196.35
Polar Surface Area: 50 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 184.5±3.0 cm3

Click to predict properties on the Chemicalize site


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