ChemSpider 2D Image | (4S,5R)-5-[(R)-Hydroxy(2-methoxy-3,5-dimethylphenyl)methyl]-4-vinyldihydro-2(3H)-furanone | C16H20O4

(4S,5R)-5-[(R)-Hydroxy(2-methoxy-3,5-dimethylphenyl)methyl]-4-vinyldihydro-2(3H)-furanone

  • Molecular FormulaC16H20O4
  • Average mass276.328 Da
  • Monoisotopic mass276.136169 Da
  • ChemSpider ID30659093

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(4S,5R)-5-[(R)-Hydroxy(2-methoxy-3,5-dimethylphenyl)methyl]-4-vinyldihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(4S,5R)-5-[(R)-Hydroxy(2-methoxy-3,5-dimethylphenyl)methyl]-4-vinyldihydro-2(3H)-furanone [ACD/IUPAC Name]
(4S,5R)-5-[(R)-Hydroxy(2-méthoxy-3,5-diméthylphényl)méthyl]-4-vinyldihydro-2(3H)-furanone [French] [ACD/IUPAC 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: 459.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 168.9±22.2 °C
Index of Refraction: 1.593
Molar Refractivity: 78.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 13.46
ACD/KOC (pH 5.5): 223.79
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 13.46
ACD/KOC (pH 7.4): 223.79
Polar Surface Area: 56 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 230.2±3.0 cm3

Click to predict properties on the Chemicalize site


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