ChemSpider 2D Image | (4S)-2,3,4,5-Tetramethyl-2-cyclopenten-1-one | C9H14O

(4S)-2,3,4,5-Tetramethyl-2-cyclopenten-1-one

  • Molecular FormulaC9H14O
  • Average mass138.207 Da
  • Monoisotopic mass138.104462 Da
  • ChemSpider ID74173701
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

(4S)-2,3,4,5-Tetramethyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
(4S)-2,3,4,5-Tetramethyl-2-cyclopenten-1-one [ACD/IUPAC Name]
(4S)-2,3,4,5-Tétraméthyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
2-Cyclopenten-1-one, 2,3,4,5-tetramethyl-, (4S)- [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: 196.1±10.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.2±3.0 kJ/mol
Flash Point: 73.3±0.0 °C
Index of Refraction: 1.451
Molar Refractivity: 41.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.51
ACD/KOC (pH 5.5): 343.69
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.51
ACD/KOC (pH 7.4): 343.69
Polar Surface Area: 17 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 24.1±3.0 dyne/cm
Molar Volume: 154.5±3.0 cm3

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