ChemSpider 2D Image | (3beta,6beta,7alpha,8beta,9alpha,10beta,11beta)-Dendroban-12-one | C16H25NO2

(3β,6β,7α,8β,9α,10β,11β)-Dendroban-12-one

  • Molecular FormulaC16H25NO2
  • Average mass263.375 Da
  • Monoisotopic mass263.188538 Da
  • ChemSpider ID113588434

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3β,6β,7α,8β,9α,10β,11β)-Dendroban-12-on [German] [ACD/IUPAC Name]
(3β,6β,7α,8β,9α,10β,11β)-Dendroban-12-one [ACD/IUPAC Name]
(3β,6β,7α,8β,9α,10β,11β)-Dendroban-12-one [French] [ACD/IUPAC Name]
5,8-Methano-6H-7-oxa-1-azacyclopent[cd]azulen-6-one, decahydro-1,8b-dimethyl-9-(1-methylethyl)-, (2aR,4aR,5S,8S,8aR,8bS,9R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 374.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 132.8±14.0 °C
Index of Refraction: 1.526
Molar Refractivity: 73.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.81
Polar Surface Area: 30 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 239.1±3.0 cm3

Click to predict properties on the Chemicalize site


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