ChemSpider 2D Image | 2-Pentanyl (2E)-3-(3,4-dihydroxyphenyl)acrylate | C14H18O4

2-Pentanyl (2E)-3-(3,4-dihydroxyphenyl)acrylate

  • Molecular FormulaC14H18O4
  • Average mass250.290 Da
  • Monoisotopic mass250.120514 Da
  • ChemSpider ID69876795

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(3,4-Dihydroxyphényl)acrylate de 2-pentanyle [French] [ACD/IUPAC Name]
2-Pentanyl (2E)-3-(3,4-dihydroxyphenyl)acrylate [ACD/IUPAC Name]
2-Pentanyl-(2E)-3-(3,4-dihydroxyphenyl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 1-methylbutyl ester, (2E)- [ACD/Index 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: 403.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 148.8±19.4 °C
Index of Refraction: 1.577
Molar Refractivity: 70.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 131.65
ACD/KOC (pH 5.5): 1144.64
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 129.27
ACD/KOC (pH 7.4): 1123.94
Polar Surface Area: 67 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 213.7±3.0 cm3

Click to predict properties on the Chemicalize site


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