ChemSpider 2D Image | (3s,5s,7s)-1-Methoxyadamantane | C11H18O

(3s,5s,7s)-1-Methoxyadamantane

  • Molecular FormulaC11H18O
  • Average mass166.260 Da
  • Monoisotopic mass166.135757 Da
  • ChemSpider ID110599699

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3s,5s,7s)-1-Methoxyadamantan [German] [ACD/IUPAC Name]
(3s,5s,7s)-1-Methoxyadamantane [ACD/IUPAC Name]
(3s,5s,7s)-1-Méthoxyadamantane [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane, 1-methoxy- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 216.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.5±3.0 kJ/mol
Flash Point: 77.6±14.2 °C
Index of Refraction: 1.509
Molar Refractivity: 48.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.04
ACD/KOC (pH 5.5): 1171.92
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.04
ACD/KOC (pH 7.4): 1171.92
Polar Surface Area: 9 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 34.0±5.0 dyne/cm
Molar Volume: 162.6±5.0 cm3

Click to predict properties on the Chemicalize site


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