ChemSpider 2D Image | (1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)-6-Hydroxy-6a,9a-dimethyl-4-(4-morpholinylmethyl)decahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-one | C19H29NO6

(1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)-6-Hydroxy-6a,9a-dimethyl-4-(4-morpholinylmethyl)decahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-one

  • Molecular FormulaC19H29NO6
  • Average mass367.437 Da
  • Monoisotopic mass367.199493 Da
  • ChemSpider ID30657351

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)-6-Hydroxy-6a,9a-dimethyl-4-(4-morpholinylmethyl)decahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-on [German] [ACD/IUPAC Name]
(1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)-6-Hydroxy-6a,9a-dimethyl-4-(4-morpholinylmethyl)decahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-one [ACD/IUPAC Name]
(1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)-6-Hydroxy-6a,9a-diméthyl-4-(4-morpholinylméthyl)décahydrobisoxiréno[5,6:9,10]cyclodéca[1,2-b]furan-3(1bH)-one [French] [ACD/IUPAC Name]
Bisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-one, decahydro-6-hydroxy-6a,9a-dimethyl-4-(4-morpholinylmethyl)-, (1aS,1bR,4S,4aR,6S,6aS,7aS,9aS)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 551.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 95.6±6.0 kJ/mol
Flash Point: 287.2±30.1 °C
Index of Refraction: 1.550
Molar Refractivity: 91.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.94
ACD/LogD (pH 5.5): -1.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.76
Polar Surface Area: 84 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 287.5±3.0 cm3

Click to predict properties on the Chemicalize site


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