ChemSpider 2D Image | Methyl (2Z)-3-{5-[(4Z)-1-hydroxy-4-hepten-2-yn-1-yl]-2-furyl}acrylate | C15H16O4

Methyl (2Z)-3-{5-[(4Z)-1-hydroxy-4-hepten-2-yn-1-yl]-2-furyl}acrylate

  • Molecular FormulaC15H16O4
  • Average mass260.285 Da
  • Monoisotopic mass260.104858 Da
  • ChemSpider ID35014749

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-{5-[(4Z)-1-Hydroxy-4-heptén-2-yn-1-yl]-2-furyl}acrylate de méthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[5-[(4Z)-1-hydroxy-4-hepten-2-yn-1-yl]-2-furanyl]-, methyl ester, (2Z)- [ACD/Index Name]
Methyl (2Z)-3-{5-[(4Z)-1-hydroxy-4-hepten-2-yn-1-yl]-2-furyl}acrylate [ACD/IUPAC Name]
Methyl-(2Z)-3-{5-[(4Z)-1-hydroxy-4-hepten-2-in-1-yl]-2-furyl}acrylat [German] [ACD/IUPAC Name]
20450-52-6 [RN]
methyl (2Z)-3-{5-[(4Z)-1-hydroxyhept-4-en-2-yn-1-yl]furan-2-yl}prop-2-enoate
Methyl 3-[5-(1-hydroxy-4-hepten-2-ynyl)-2-furanyl]-2-propenoate
Wyerol

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

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

Density: 1.2±0.1 g/cm3
Boiling Point: 385.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.9±3.0 kJ/mol
Flash Point: 187.0±27.9 °C
Index of Refraction: 1.568
Molar Refractivity: 73.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 109.04
ACD/KOC (pH 5.5): 1000.29
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 109.04
ACD/KOC (pH 7.4): 1000.23
Polar Surface Area: 60 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 223.7±3.0 cm3

Click to predict properties on the Chemicalize site


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