ChemSpider 2D Image | GLYCERYL 1,3-DIFERULATE | C23H24O9

GLYCERYL 1,3-DIFERULATE

  • Molecular FormulaC23H24O9
  • Average mass444.431 Da
  • Monoisotopic mass444.142029 Da
  • ChemSpider ID32697544

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,2'E)Bis[3-(4-hydroxy-3-méthoxyphényl)acrylate] de 2-hydroxy-1,3-propanediyle [French] [ACD/IUPAC Name]
1,3-O-Diferuloylglycerol
2-Hydroxy-1,3-propandiyl-(2E,2'E)bis[3-(4-hydroxy-3-methoxyphenyl)acrylat] [German] [ACD/IUPAC Name]
2-Hydroxy-1,3-propanediyl (2E,2'E)bis[3-(4-hydroxy-3-methoxyphenyl)acrylate] [ACD/IUPAC Name]
2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 2-hydroxy-1,3-propanediyl ester, (2E,2'E)- [ACD/Index Name]
83008-46-2 [RN]
GLYCERYL 1,3-DIFERULATE
2-PROPENOIC ACID 3-(4-HYDROXY-3-METHOXYPHENYL)- 1 1'-(2-HYDROXY-1 3-PROPANEDIYL) ESTER (2E 2'E)-

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

0NZ7B3417J [DBID]
UNII:0NZ7B3417J [DBID]
UNII-0NZ7B3417J [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 634.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 216.1±25.0 °C
Index of Refraction: 1.632
Molar Refractivity: 118.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.04
ACD/KOC (pH 5.5): 275.90
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 17.87
ACD/KOC (pH 7.4): 273.37
Polar Surface Area: 132 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 331.5±3.0 cm3

Click to predict properties on the Chemicalize site


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