ChemSpider 2D Image | (2R)-3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1-propanone | C17H18O6

(2R)-3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1-propanone

  • Molecular FormulaC17H18O6
  • Average mass318.321 Da
  • Monoisotopic mass318.110352 Da
  • ChemSpider ID23318926

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1-propanon [German] [ACD/IUPAC Name]
(2R)-3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1-propanone [ACD/IUPAC Name]
(2R)-3-Hydroxy-1-(4-hydroxy-3-méthoxyphényl)-2-(2-méthoxyphénoxy)-1-propanone [French] [ACD/IUPAC Name]
(2R)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
1-Propanone, 3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-, (2R)- [ACD/Index Name]
(-)-(&β;<i&gt;R</i>)-&;α;-(2-methoxyphenoxy)-&β;-hydroxypropiovanillone
(-)-(&β;<i&gt;R</i>)-MPHPV
(R)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL430042/
MPHPV II

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

Density: 1.3±0.1 g/cm3
Boiling Point: 548.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 201.5±23.6 °C
Index of Refraction: 1.585
Molar Refractivity: 83.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.46
ACD/KOC (pH 5.5): 246.74
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 11.19
ACD/KOC (pH 7.4): 178.61
Polar Surface Area: 85 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 250.2±3.0 cm3

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