ChemSpider 2D Image | 6-[(2E)-1-Hydroxy-2-buten-2-yl]-4-methoxy-3-methyl-2H-pyran-2-one | C11H14O4

6-[(2E)-1-Hydroxy-2-buten-2-yl]-4-methoxy-3-methyl-2H-pyran-2-one

  • Molecular FormulaC11H14O4
  • Average mass210.227 Da
  • Monoisotopic mass210.089203 Da
  • ChemSpider ID44210752

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyran-2-one, 6-[(1E)-1-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-3-methyl- [ACD/Index Name]
6-[(2E)-1-Hydroxy-2-buten-2-yl]-4-methoxy-3-methyl-2H-pyran-2-on [German] [ACD/IUPAC Name]
6-[(2E)-1-Hydroxy-2-buten-2-yl]-4-methoxy-3-methyl-2H-pyran-2-one [ACD/IUPAC Name]
6-[(2E)-1-Hydroxy-2-butén-2-yl]-4-méthoxy-3-méthyl-2H-pyran-2-one [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: 414.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±6.0 kJ/mol
Flash Point: 164.2±19.4 °C
Index of Refraction: 1.528
Molar Refractivity: 54.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.90
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 4.05
ACD/KOC (pH 5.5): 94.70
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 4.05
ACD/KOC (pH 7.4): 94.70
Polar Surface Area: 56 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 178.3±5.0 cm3

Click to predict properties on the Chemicalize site


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