ChemSpider 2D Image | (3E)-3-(4-Butoxy-3-ethoxybenzylidene)-1,1'-bi(cyclopentyl)-2-one | C23H32O3

(3E)-3-(4-Butoxy-3-ethoxybenzylidene)-1,1'-bi(cyclopentyl)-2-one

  • Molecular FormulaC23H32O3
  • Average mass356.498 Da
  • Monoisotopic mass356.235138 Da
  • ChemSpider ID22947331

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-3-(4-Butoxy-3-ethoxybenzyliden)-1,1'-bi(cyclopentyl)-2-on [German] [ACD/IUPAC Name]
(3E)-3-(4-Butoxy-3-ethoxybenzylidene)-1,1'-bi(cyclopentyl)-2-one [ACD/IUPAC Name]
(3E)-3-(4-Butoxy-3-éthoxybenzylidène)-1,1'-bi(cyclopentyl)-2-one [French] [ACD/IUPAC Name]
[1,1'-Bicyclopentyl]-2-one, 3-[(4-butoxy-3-ethoxyphenyl)methylene]-, (3E)- [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: 505.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 252.1±16.5 °C
Index of Refraction: 1.562
Molar Refractivity: 106.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.50
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28431.50
ACD/KOC (pH 5.5): 53655.50
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28431.50
ACD/KOC (pH 7.4): 53655.50
Polar Surface Area: 36 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 43.9±3.0 dyne/cm
Molar Volume: 329.4±3.0 cm3

Click to predict properties on the Chemicalize site


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