ChemSpider 2D Image | 3,5-Octadien-2-one | C8H12O

3,5-Octadien-2-one

  • Molecular FormulaC8H12O
  • Average mass124.180 Da
  • Monoisotopic mass124.088814 Da
  • ChemSpider ID23254193

More details:






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

3,5-Octadien-2-on [German] [ACD/IUPAC Name]
3,5-Octadien-2-one [ACD/Index Name] [ACD/IUPAC Name]
3,5-Octadién-2-one [French] [ACD/IUPAC Name]
octa-3,5-dien-2-one
(E,Z)-octa-3,5-dien-2-one
30086-02-3 [RN]
38284-27-4 [RN]
4173-41-5 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 194.6±9.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.1±3.0 kJ/mol
Flash Point: 69.3±11.9 °C
Index of Refraction: 1.454
Molar Refractivity: 39.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.08
ACD/KOC (pH 5.5): 297.97
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.08
ACD/KOC (pH 7.4): 297.97
Polar Surface Area: 17 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 26.8±3.0 dyne/cm
Molar Volume: 144.9±3.0 cm3

Click to predict properties on the Chemicalize site






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