ChemSpider 2D Image | (3E)-5-[Hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyl-2,4,6-dodecatrien-1-ylidene]-2,4-pyrrolidinedione | C26H33NO5

(3E)-5-[Hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyl-2,4,6-dodecatrien-1-ylidene]-2,4-pyrrolidinedione

  • Molecular FormulaC26H33NO5
  • Average mass439.544 Da
  • Monoisotopic mass439.235870 Da
  • ChemSpider ID24535934
  • Double-bond stereo - Double-bond stereo


More details:






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

(3E)-5-[Hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyl-2,4,6-dodecatrien-1-yliden]-2,4-pyrrolidindion [German] [ACD/IUPAC Name]
(3E)-5-[Hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyl-2,4,6-dodecatrien-1-ylidene]-2,4-pyrrolidinedione [ACD/IUPAC Name]
(3E)-5-[Hydroxy(4-hydroxyphényl)méthyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-triméthyl-2,4,6-dodécatrién-1-ylidène]-2,4-pyrrolidinedione [French] [ACD/IUPAC Name]
(3E)-5-[Hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyldodeca-2,4,6-trien-1-ylidene]pyrrolidine-2,4-dione
2,4-Pyrrolidinedione, 5-[hydroxy(4-hydroxyphenyl)methyl]-3-[(2E,4E,6E)-1-hydroxy-6,8,10-trimethyl-2,4,6-dodecatrien-1-ylidene]-, (3E)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 688.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 369.9±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 125.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 8.03
ACD/KOC (pH 5.5): 64.89
ACD/LogD (pH 7.4): 0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.27
Polar Surface Area: 107 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 371.6±3.0 cm3

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