ChemSpider 2D Image | (3E)-3-(1-Hydroxy-2-methylbutylidene)-5,6-dimethyldihydro-2H-pyran-2,4(3H)-dione | C12H18O4

(3E)-3-(1-Hydroxy-2-methylbutylidene)-5,6-dimethyldihydro-2H-pyran-2,4(3H)-dione

  • Molecular FormulaC12H18O4
  • Average mass226.269 Da
  • Monoisotopic mass226.120514 Da
  • ChemSpider ID78444634

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-3-(1-Hydroxy-2-methylbutyliden)-5,6-dimethyldihydro-2H-pyran-2,4(3H)-dion [German] [ACD/IUPAC Name]
(3E)-3-(1-Hydroxy-2-methylbutylidene)-5,6-dimethyldihydro-2H-pyran-2,4(3H)-dione [ACD/IUPAC Name]
(3E)-3-(1-Hydroxy-2-méthylbutylidène)-5,6-diméthyldihydro-2H-pyrane-2,4(3H)-dione [French] [ACD/IUPAC Name]
2H-Pyran-2,4(3H)-dione, dihydro-3-(1-hydroxy-2-methylbutylidene)-5,6-dimethyl-, (3E)- [ACD/Index Name]
Fujikurin D

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

Density: 1.1±0.1 g/cm3
Boiling Point: 367.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.1±6.0 kJ/mol
Flash Point: 137.7±21.4 °C
Index of Refraction: 1.488
Molar Refractivity: 58.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.89
ACD/LogD (pH 7.4): -1.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 203.3±3.0 cm3

Click to predict properties on the Chemicalize site


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