ChemSpider 2D Image | (1S,2R,4S,6R,7S,1'R,2'S,4'S,6'R,7'S)-4,4'-Oxybis(1,10,10-trimethyl-3-oxatricyclo[5.2.1.0~2,6~]decane) | C24H38O3

(1S,2R,4S,6R,7S,1'R,2'S,4'S,6'R,7'S)-4,4'-Oxybis(1,10,10-trimethyl-3-oxatricyclo[5.2.1.02,6]decane)

  • Molecular FormulaC24H38O3
  • Average mass374.557 Da
  • Monoisotopic mass374.282104 Da
  • ChemSpider ID103846944

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(1S,2R,4S,6R,7S,1'R,2'S,4'S,6'R,7'S)-4,4'-Oxybis(1,10,10-trimethyl-3-oxatricyclo[5.2.1.02,6]decan) [German] [ACD/IUPAC Name]
(1S,2R,4S,6R,7S,1'R,2'S,4'S,6'R,7'S)-4,4'-Oxybis(1,10,10-trimethyl-3-oxatricyclo[5.2.1.02,6]decane) [ACD/IUPAC Name]
(1S,2R,4S,6R,7S,1'R,2'S,4'S,6'R,7'S)-4,4'-Oxybis(1,10,10-triméthyl-3-oxatricyclo[5.2.1.02,6]décane) [French] [ACD/IUPAC Name]
4,7-Methanobenzofuran, 2,2'-oxybis[octahydro-7,8,8-trimethyl-, (2S,3aR,4S,7S,7aR,2'S,3'aR,4'S,7'R,7'aS)- [ACD/Index Name]
108031-79-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 435.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 148.7±21.8 °C
Index of Refraction: 1.547
Molar Refractivity: 106.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.40
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5822.31
ACD/KOC (pH 5.5): 17244.36
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5822.31
ACD/KOC (pH 7.4): 17244.36
Polar Surface Area: 28 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 40.6±5.0 dyne/cm
Molar Volume: 334.4±5.0 cm3

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