ChemSpider 2D Image | (4S)-3,4-Dimethyl-2-cyclopenten-1-one | C7H10O

(4S)-3,4-Dimethyl-2-cyclopenten-1-one

  • Molecular FormulaC7H10O
  • Average mass110.154 Da
  • Monoisotopic mass110.073166 Da
  • ChemSpider ID32787835

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-3,4-Dimethyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
(4S)-3,4-Dimethyl-2-cyclopenten-1-one [ACD/IUPAC Name]
(4S)-3,4-Diméthyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
2-Cyclopenten-1-one, 3,4-dimethyl-, (4S)- [ACD/Index Name]
852449-48-0 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 167.5±10.0 °C at 760 mmHg
Vapour Pressure: 1.7±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.4±3.0 kJ/mol
Flash Point: 58.9±9.8 °C
Index of Refraction: 1.465
Molar Refractivity: 32.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 5.09
ACD/KOC (pH 5.5): 111.59
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 5.09
ACD/KOC (pH 7.4): 111.59
Polar Surface Area: 17 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 116.5±3.0 cm3

Click to predict properties on the Chemicalize site


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