ChemSpider 2D Image | (2S)-2-Methylcyclooctanone | C9H16O

(2S)-2-Methylcyclooctanone

  • Molecular FormulaC9H16O
  • Average mass140.223 Da
  • Monoisotopic mass140.120117 Da
  • ChemSpider ID61652988

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Methylcyclooctanon [German] [ACD/IUPAC Name]
(2S)-2-Methylcyclooctanone [ACD/IUPAC Name]
(2S)-2-Méthylcyclooctanone [French] [ACD/IUPAC Name]
Cyclooctanone, 2-methyl-, (2S)- [ACD/Index Name]
77857-44-4 [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: 205.3±8.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.2±3.0 kJ/mol
Flash Point: 70.9±10.7 °C
Index of Refraction: 1.440
Molar Refractivity: 41.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 58.00
ACD/KOC (pH 5.5): 636.59
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 58.00
ACD/KOC (pH 7.4): 636.59
Polar Surface Area: 17 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 158.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement