ChemSpider 2D Image | Ethyl (1S)-3-cyclohexene-1-carboxylate | C9H14O2

Ethyl (1S)-3-cyclohexene-1-carboxylate

  • Molecular FormulaC9H14O2
  • Average mass154.206 Da
  • Monoisotopic mass154.099380 Da
  • ChemSpider ID75571743

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-3-Cyclohexène-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Cyclohexene-1-carboxylic acid, ethyl ester, (1S)- [ACD/Index Name]
Ethyl (1S)-3-cyclohexene-1-carboxylate [ACD/IUPAC Name]
Ethyl-(1S)-3-cyclohexen-1-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 196.6±19.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.3±3.0 kJ/mol
Flash Point: 63.0±9.0 °C
Index of Refraction: 1.469
Molar Refractivity: 42.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.52
ACD/KOC (pH 5.5): 411.45
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.52
ACD/KOC (pH 7.4): 411.45
Polar Surface Area: 26 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 153.9±3.0 cm3

Click to predict properties on the Chemicalize site


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