ChemSpider 2D Image | 1-Cyclopropyl-3-methyl-1-butanone | C8H14O

1-Cyclopropyl-3-methyl-1-butanone

  • Molecular FormulaC8H14O
  • Average mass126.196 Da
  • Monoisotopic mass126.104462 Da
  • ChemSpider ID37482198

More details:

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

1-Butanone, 1-cyclopropyl-3-methyl- [ACD/Index Name]
1-Cyclopropyl-3-methyl-1-butanon [German] [ACD/IUPAC Name]
1-Cyclopropyl-3-methyl-1-butanone [ACD/IUPAC Name]
1-Cyclopropyl-3-méthyl-1-butanone [French] [ACD/IUPAC Name]
54187-23-4 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 161.6±8.0 °C at 760 mmHg
Vapour Pressure: 2.3±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.8±3.0 kJ/mol
Flash Point: 53.9±6.1 °C
Index of Refraction: 1.461
Molar Refractivity: 36.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.62
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 10.03
ACD/KOC (pH 5.5): 181.31
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 10.03
ACD/KOC (pH 7.4): 181.31
Polar Surface Area: 17 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 134.4±3.0 cm3

Click to predict properties on the Chemicalize site


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