ChemSpider 2D Image | (3E,5Z)-5-Ethylidene-3-[(6E)-1-hydroxy-2-methyl-6-octen-1-ylidene]-1-methyl-2,4-pyrrolidinedione | C16H23NO3

(3E,5Z)-5-Ethylidene-3-[(6E)-1-hydroxy-2-methyl-6-octen-1-ylidene]-1-methyl-2,4-pyrrolidinedione

  • Molecular FormulaC16H23NO3
  • Average mass277.359 Da
  • Monoisotopic mass277.167786 Da
  • ChemSpider ID35516659

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E,5Z)-5-Ethyliden-3-[(6E)-1-hydroxy-2-methyl-6-octen-1-yliden]-1-methyl-2,4-pyrrolidindion [German] [ACD/IUPAC Name]
(3E,5Z)-5-Ethylidene-3-[(6E)-1-hydroxy-2-methyl-6-octen-1-ylidene]-1-methyl-2,4-pyrrolidinedione [ACD/IUPAC Name]
(3E,5Z)-5-Éthylidène-3-[(6E)-1-hydroxy-2-méthyl-6-octén-1-ylidène]-1-méthyl-2,4-pyrrolidinedione [French] [ACD/IUPAC Name]
2,4-Pyrrolidinedione, 5-ethylidene-3-[(6E)-1-hydroxy-2-methyl-6-octen-1-ylidene]-1-methyl-, (3E,5Z)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 462.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.4±6.0 kJ/mol
Flash Point: 233.3±28.7 °C
Index of Refraction: 1.580
Molar Refractivity: 80.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 3.11
ACD/KOC (pH 5.5): 39.70
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 242.4±3.0 cm3

Click to predict properties on the Chemicalize site


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