ChemSpider 2D Image | 3-[(2Z)-2-(3,5-Dimethyl-2-oxo-3-cyclohexen-1-ylidene)ethyl]pentanedioic acid | C15H20O5

3-[(2Z)-2-(3,5-Dimethyl-2-oxo-3-cyclohexen-1-ylidene)ethyl]pentanedioic acid

  • Molecular FormulaC15H20O5
  • Average mass280.316 Da
  • Monoisotopic mass280.131073 Da
  • ChemSpider ID40256884

  • Double-bond stereo - Double-bond stereo

More details:

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

3-[(2Z)-2-(3,5-Dimethyl-2-oxo-3-cyclohexen-1-yliden)ethyl]pentandisäure [German] [ACD/IUPAC Name]
3-[(2Z)-2-(3,5-Dimethyl-2-oxo-3-cyclohexen-1-ylidene)ethyl]pentanedioic acid [ACD/IUPAC Name]
Acide 3-[(2Z)-2-(3,5-diméthyl-2-oxo-3-cyclohexén-1-ylidène)éthyl]pentanedioïque [French] [ACD/IUPAC Name]
Pentanedioic acid, 3-[(2Z)-2-(3,5-dimethyl-2-oxo-3-cyclohexen-1-ylidene)ethyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 500.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 84.2±6.0 kJ/mol
Flash Point: 270.4±26.6 °C
Index of Refraction: 1.576
Molar Refractivity: 74.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.38
ACD/LogD (pH 7.4): -3.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 223.6±3.0 cm3

Click to predict properties on the Chemicalize site


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