ChemSpider 2D Image | (1R,4S)-1,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde | C10H14O2

(1R,4S)-1,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde

  • Molecular FormulaC10H14O2
  • Average mass166.217 Da
  • Monoisotopic mass166.099380 Da
  • ChemSpider ID30791045
  • defined stereocentres - 2 of 3 defined stereocentres


More details:






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

(1R,4S)-1,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-7-carbaldehyd [German] [ACD/IUPAC Name]
(1R,4S)-1,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-7-carbaldehyde [ACD/IUPAC Name]
(1R,4S)-1,7-Diméthyl-2-oxobicyclo[2.2.1]heptane-7-carbaldéhyde [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-7-carboxaldehyde, 1,7-dimethyl-2-oxo-, (1R,4S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 244.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.1±3.0 kJ/mol
Flash Point: 89.6±19.6 °C
Index of Refraction: 1.568
Molar Refractivity: 46.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.10
ACD/KOC (pH 5.5): 127.05
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.10
ACD/KOC (pH 7.4): 127.05
Polar Surface Area: 34 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 141.5±3.0 cm3

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