ChemSpider 2D Image | (2E)-3-[5-(Hydroxymethyl)-4-methoxy-2-oxo-2H-pyran-6-yl]acrylic acid | C10H10O6

(2E)-3-[5-(Hydroxymethyl)-4-methoxy-2-oxo-2H-pyran-6-yl]acrylic acid

  • Molecular FormulaC10H10O6
  • Average mass226.183 Da
  • Monoisotopic mass226.047745 Da
  • ChemSpider ID44210749

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[5-(Hydroxymethyl)-4-methoxy-2-oxo-2H-pyran-6-yl]acrylic acid [ACD/IUPAC Name]
(2E)-3-[5-(Hydroxymethyl)-4-methoxy-2-oxo-2H-pyran-6-yl]acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-[5-(hydroxymethyl)-4-methoxy-2-oxo-2H-pyran-6-yl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-[5-(hydroxyméthyl)-4-méthoxy-2-oxo-2H-pyran-6-yl]acrylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 470.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 84.5±6.0 kJ/mol
Flash Point: 190.3±22.2 °C
Index of Refraction: 1.580
Molar Refractivity: 52.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.50
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 61.0±5.0 dyne/cm
Molar Volume: 156.6±5.0 cm3

Click to predict properties on the Chemicalize site


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