ChemSpider 2D Image | 1-(2,2-Dimethylcyclopropyl)-1-butanone | C9H16O

1-(2,2-Dimethylcyclopropyl)-1-butanone

  • Molecular FormulaC9H16O
  • Average mass140.223 Da
  • Monoisotopic mass140.120117 Da
  • ChemSpider ID55376637

More details:






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

1-(2,2-Dimethylcyclopropyl)-1-butanon [German] [ACD/IUPAC Name]
1-(2,2-Dimethylcyclopropyl)-1-butanone [ACD/IUPAC Name]
1-(2,2-Diméthylcyclopropyl)-1-butanone [French] [ACD/IUPAC Name]
1-Butanone, 1-(2,2-dimethylcyclopropyl)- [ACD/Index Name]
1-(2,2-dimethylcyclopropyl)butan-1-one
1695002-73-3 [RN]
MFCD29060367

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

Density: 0.9±0.1 g/cm3
Boiling Point: 177.0±8.0 °C at 760 mmHg
Vapour Pressure: 1.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.3±3.0 kJ/mol
Flash Point: 65.9±6.1 °C
Index of Refraction: 1.447
Molar Refractivity: 41.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.14
ACD/KOC (pH 5.5): 417.19
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.14
ACD/KOC (pH 7.4): 417.19
Polar Surface Area: 17 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 28.5±3.0 dyne/cm
Molar Volume: 155.9±3.0 cm3

Click to predict properties on the Chemicalize site






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