ChemSpider 2D Image | (R)-Bromoenol lactone | C16H13BrO2

(R)-Bromoenol lactone

  • Molecular FormulaC16H13BrO2
  • Average mass317.177 Da
  • Monoisotopic mass316.009888 Da
  • ChemSpider ID29341916
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3R,6E)-6-(Brommethylen)-3-(1-naphthyl)tetrahydro-2H-pyran-2-on [German] [ACD/IUPAC Name]
(3R,6E)-6-(Bromomethylene)-3-(1-naphthyl)tetrahydro-2H-pyran-2-one [ACD/IUPAC Name]
(3R,6E)-6-(Bromométhylène)-3-(1-naphtyl)tétrahydro-2H-pyran-2-one [French] [ACD/IUPAC Name]
(R)-Bromoenol lactone
2H-Pyran-2-one, 6-(bromomethylene)tetrahydro-3-(1-naphthalenyl)-, (3R,6E)- [ACD/Index Name]
478288-90-3 [RN]
(3R,6E)-6-(bromomethylidene)-3-naphthalen-1-yloxan-2-one
(R)-BEL
(R)-Bromoenol lactone-d7
(R,E)-6-(Bromomethylene)-3-(naphthalen-1-yl)tetrahydro-2H-pyran-2-one
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 467.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 236.2±28.7 °C
Index of Refraction: 1.716
Molar Refractivity: 81.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1175.23
ACD/KOC (pH 5.5): 5485.21
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1175.23
ACD/KOC (pH 7.4): 5485.21
Polar Surface Area: 26 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 206.2±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement