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Search term: 78442083 (Found by CSID)
ChemSpider 2D Image | (5R)-3,5-Dihydroxy-5-(4-hydroxybenzyl)-4-(4-hydroxyphenyl)-2(5H)-furanone | C17H14O6

(5R)-3,5-Dihydroxy-5-(4-hydroxybenzyl)-4-(4-hydroxyphenyl)-2(5H)-furanone

  • Molecular FormulaC17H14O6
  • Average mass314.289 Da
  • Monoisotopic mass314.079041 Da
  • ChemSpider ID78442083

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5R)-3,5-Dihydroxy-5-(4-hydroxybenzyl)-4-(4-hydroxyphenyl)-2(5H)-furanon [German] [ACD/IUPAC Name]
(5R)-3,5-Dihydroxy-5-(4-hydroxybenzyl)-4-(4-hydroxyphenyl)-2(5H)-furanone [ACD/IUPAC Name]
(5R)-3,5-Dihydroxy-5-(4-hydroxybenzyl)-4-(4-hydroxyphényl)-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 3,5-dihydroxy-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methyl]-, (5R)- [ACD/Index Name]
4-O-demethylisobutyrolactone II

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

Density: 1.6±0.1 g/cm3
Boiling Point: 675.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 255.2±25.0 °C
Index of Refraction: 1.748
Molar Refractivity: 80.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.47
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.36
ACD/KOC (pH 5.5): 115.68
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 5.09
ACD/KOC (pH 7.4): 109.82
Polar Surface Area: 107 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 94.3±3.0 dyne/cm
Molar Volume: 197.3±3.0 cm3

Click to predict properties on the Chemicalize site


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