Found 7 results

Search term: LUVVJRSICOPRSN (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3S)-2-Bromo-3-ethylcyclohexanone | C8H13BrO

(3S)-2-Bromo-3-ethylcyclohexanone

  • Molecular FormulaC8H13BrO
  • Average mass205.092 Da
  • Monoisotopic mass204.014969 Da
  • ChemSpider ID61504063

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(3S)-2-Brom-3-ethylcyclohexanon [German] [ACD/IUPAC Name]
(3S)-2-Bromo-3-ethylcyclohexanone [ACD/IUPAC Name]
(3S)-2-Bromo-3-éthylcyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2-bromo-3-ethyl-, (3S)- [ACD/Index Name]
865089-83-4 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 237.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 58.0±12.7 °C
Index of Refraction: 1.492
Molar Refractivity: 44.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.36
ACD/KOC (pH 5.5): 321.81
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 22.36
ACD/KOC (pH 7.4): 321.81
Polar Surface Area: 17 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 154.9±3.0 cm3

Click to predict properties on the Chemicalize site


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