ChemSpider 2D Image | 1-[(1S)-2,2-Dimethylcyclopropyl]-1-propanone | C8H14O

1-[(1S)-2,2-Dimethylcyclopropyl]-1-propanone

  • Molecular FormulaC8H14O
  • Average mass126.196 Da
  • Monoisotopic mass126.104462 Da
  • ChemSpider ID32789211

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-[(1S)-2,2-Dimethylcyclopropyl]-1-propanon [German] [ACD/IUPAC Name]
1-[(1S)-2,2-Dimethylcyclopropyl]-1-propanone [ACD/IUPAC Name]
1-[(1S)-2,2-Diméthylcyclopropyl]-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[(1S)-2,2-dimethylcyclopropyl]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 157.0±8.0 °C at 760 mmHg
Vapour Pressure: 2.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.4±3.0 kJ/mol
Flash Point: 52.1±6.1 °C
Index of Refraction: 1.443
Molar Refractivity: 37.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.76
ACD/KOC (pH 5.5): 250.47
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.76
ACD/KOC (pH 7.4): 250.47
Polar Surface Area: 17 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 27.8±3.0 dyne/cm
Molar Volume: 139.4±3.0 cm3

Click to predict properties on the Chemicalize site


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