ChemSpider 2D Image | 1-Cyclobutyl-2-propyn-1-one | C7H8O

1-Cyclobutyl-2-propyn-1-one

  • Molecular FormulaC7H8O
  • Average mass108.138 Da
  • Monoisotopic mass108.057518 Da
  • ChemSpider ID29785176

More details:

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

1-Cyclobutyl-2-propin-1-on [German] [ACD/IUPAC Name]
1-Cyclobutyl-2-propyn-1-one [ACD/IUPAC Name]
1-Cyclobutyl-2-propyn-1-one [French] [ACD/IUPAC Name]
2-Propyn-1-one, 1-cyclobutyl- [ACD/Index Name]
1466042-76-1 [RN]
1-Cyclobutylprop-2-yn-1-one
MFCD21263108 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 168.3±7.0 °C at 760 mmHg
Vapour Pressure: 1.6±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.5±3.0 kJ/mol
Flash Point: 56.8±15.2 °C
Index of Refraction: 1.499
Molar Refractivity: 30.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.37
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.47
ACD/KOC (pH 5.5): 132.45
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.47
ACD/KOC (pH 7.4): 132.45
Polar Surface Area: 17 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 102.5±3.0 cm3

Click to predict properties on the Chemicalize site


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