ChemSpider 2D Image | 2-Ethynyl-2-cyclopenten-1-one | C7H6O

2-Ethynyl-2-cyclopenten-1-one

  • Molecular FormulaC7H6O
  • Average mass106.122 Da
  • Monoisotopic mass106.041862 Da
  • ChemSpider ID28605143

More details:

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

2-Cyclopenten-1-one, 2-ethynyl- [ACD/Index Name]
2-Ethinyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
2-Ethynyl-2-cyclopenten-1-one [ACD/IUPAC Name]
2-Éthynyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
1435806-87-3 [RN]
2-Ethynylcyclopent-2-en-1-one
MFCD24842584 [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: 180.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.7±3.0 kJ/mol
Flash Point: 62.4±19.5 °C
Index of Refraction: 1.508
Molar Refractivity: 30.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.87
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.62
ACD/KOC (pH 5.5): 104.14
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.62
ACD/KOC (pH 7.4): 104.14
Polar Surface Area: 17 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 37.5±5.0 dyne/cm
Molar Volume: 100.7±5.0 cm3

Click to predict properties on the Chemicalize site


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