ChemSpider 2D Image | (1R,2S,4R,6R)-2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octane | C10H16O

(1R,2S,4R,6R)-2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octane

  • Molecular FormulaC10H16O
  • Average mass152.233 Da
  • Monoisotopic mass152.120117 Da
  • ChemSpider ID61588615

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,2S,4R,6R)-2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octan [German] [ACD/IUPAC Name]
(1R,2S,4R,6R)-2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octane [ACD/IUPAC Name]
(1R,2S,4R,6R)-2,7,7-Triméthyl-3-oxatricyclo[4.1.1.02,4]octane [French] [ACD/IUPAC Name]
(1R,2S,4R,6R)-2,7,7-Trimethyl-3-oxatricyclo[4.1.1.02,4]octane
38301-46-1 [RN]
3-Oxatricyclo[4.1.1.02,4]octane, 2,7,7-trimethyl-, (1R,2S,4R,6R)- [ACD/Index Name]
94063-22-6 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 188.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.7±3.0 kJ/mol
Flash Point: 65.6±0.0 °C
Index of Refraction: 1.505
Molar Refractivity: 43.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 30.30
ACD/KOC (pH 5.5): 400.02
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.30
ACD/KOC (pH 7.4): 400.02
Polar Surface Area: 13 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 148.2±3.0 cm3

Click to predict properties on the Chemicalize site


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