ChemSpider 2D Image | (2E,6E)-4-Ethyl-2,6-bis(4-isopropoxy-3-methoxybenzylidene)cyclohexanone | C30H38O5

(2E,6E)-4-Ethyl-2,6-bis(4-isopropoxy-3-methoxybenzylidene)cyclohexanone

  • Molecular FormulaC30H38O5
  • Average mass478.620 Da
  • Monoisotopic mass478.271912 Da
  • ChemSpider ID22947467

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,6E)-4-Ethyl-2,6-bis(4-isopropoxy-3-methoxybenzyliden)cyclohexanon [German] [ACD/IUPAC Name]
(2E,6E)-4-Ethyl-2,6-bis(4-isopropoxy-3-methoxybenzylidene)cyclohexanone [ACD/IUPAC Name]
(2E,6E)-4-Éthyl-2,6-bis(4-isopropoxy-3-méthoxybenzylidène)cyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 4-ethyl-2,6-bis[[3-methoxy-4-(1-methylethoxy)phenyl]methylene]-, (2E,6E)- [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: 629.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 265.1±31.5 °C
Index of Refraction: 1.568
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 8.45
ACD/LogD (pH 5.5): 6.82
ACD/BCF (pH 5.5): 89551.74
ACD/KOC (pH 5.5): 121975.93
ACD/LogD (pH 7.4): 6.82
ACD/BCF (pH 7.4): 89551.74
ACD/KOC (pH 7.4): 121975.93
Polar Surface Area: 54 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 438.9±3.0 cm3

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