ChemSpider 2D Image | parishin D | C20H20O9

parishin D

  • Molecular FormulaC20H20O9
  • Average mass404.367 Da
  • Monoisotopic mass404.110718 Da
  • ChemSpider ID28283996

More details:

Featured data source
Natural Product Updates

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,3-bis[(4-hydroxyphenyl)methyl] ester [ACD/Index Name]
2-Hydroxy-4-[(4-hydroxybenzyl)oxy]-2-{2-[(4-hydroxybenzyl)oxy]-2-oxoethyl}-4-oxobutanoic acid [ACD/IUPAC Name]
2-Hydroxy-4-[(4-hydroxybenzyl)oxy]-2-{2-[(4-hydroxybenzyl)oxy]-2-oxoethyl}-4-oxobutansäure [German] [ACD/IUPAC Name]
952068-64-3 [RN]
Acide 2-hydroxy-4-[(4-hydroxybenzyl)oxy]-2-{2-[(4-hydroxybenzyl)oxy]-2-oxoéthyl}-4-oxobutanoïque [French] [ACD/IUPAC Name]
parishin D

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

Density: 1.5±0.1 g/cm3
Boiling Point: 685.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 243.4±25.0 °C
Index of Refraction: 1.626
Molar Refractivity: 98.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): -0.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 278.0±3.0 cm3

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