ChemSpider 2D Image | cyclobutyl 3,4-dimethylphenyl ketone | C13H16O

cyclobutyl 3,4-dimethylphenyl ketone

  • Molecular FormulaC13H16O
  • Average mass188.266 Da
  • Monoisotopic mass188.120117 Da
  • ChemSpider ID21398836

More details:

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

898790-76-6 [RN]
cyclobutyl 3,4-dimethylphenyl ketone
Cyclobutyl(3,4-dimethylphenyl)methanon [German] [ACD/IUPAC Name]
Cyclobutyl(3,4-dimethylphenyl)methanone [ACD/IUPAC Name]
Cyclobutyl(3,4-diméthylphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, cyclobutyl(3,4-dimethylphenyl)- [ACD/Index Name]
cyclobutyl-(3,4-dimethylphenyl)methanone
MFCD03841268 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 307.9±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.9±3.0 kJ/mol
Flash Point: 130.0±14.2 °C
Index of Refraction: 1.553
Molar Refractivity: 57.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 416.23
ACD/KOC (pH 5.5): 2609.29
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 416.23
ACD/KOC (pH 7.4): 2609.29
Polar Surface Area: 17 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 180.5±3.0 cm3

Click to predict properties on the Chemicalize site


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