ChemSpider 2D Image | 3-(2,4-Dihydroxy-3-furyl)-2-propynoic acid | C7H4O5

3-(2,4-Dihydroxy-3-furyl)-2-propynoic acid

  • Molecular FormulaC7H4O5
  • Average mass168.104 Da
  • Monoisotopic mass168.005875 Da
  • ChemSpider ID87262522

More details:

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

2-Propynoic acid, 3-(2,4-dihydroxy-3-furanyl)- [ACD/Index Name]
3-(2,4-Dihydroxy-3-furyl)-2-propinsäure [German] [ACD/IUPAC Name]
3-(2,4-Dihydroxy-3-furyl)-2-propynoic acid [ACD/IUPAC Name]
Acide 3-(2,4-dihydroxy-3-furyl)-2-propynoïque [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 424.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 210.7±28.7 °C
Index of Refraction: 1.689
Molar Refractivity: 35.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): -3.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 117.4±5.0 dyne/cm
Molar Volume: 93.9±5.0 cm3

Click to predict properties on the Chemicalize site


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