ChemSpider 2D Image | linardosinene A | C15H22O3

linardosinene A

  • Molecular FormulaC15H22O3
  • Average mass250.333 Da
  • Monoisotopic mass250.156891 Da
  • ChemSpider ID94989091

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,2S,8S,8aS)-1-Acetyl-8,8a-dimethyl-1,2,3,4,6,7,8,8a-octahydro-2-naphthalenyl formate [ACD/IUPAC Name]
(1R,2S,8S,8aS)-1-Acetyl-8,8a-dimethyl-1,2,3,4,6,7,8,8a-octahydro-2-naphthalinylformiat [German] [ACD/IUPAC Name]
Ethanone, 1-[(1R,2S,8S,8aS)-2-(formyloxy)-1,2,3,4,6,7,8,8a-octahydro-8,8a-dimethyl-1-naphthalenyl]- [ACD/Index Name]
Formiate de (1R,2S,8S,8aS)-1-acétyl-8,8a-diméthyl-1,2,3,4,6,7,8,8a-octahydro-2-naphtalényle [French] [ACD/IUPAC Name]
linardosinene A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 346.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.1±3.0 kJ/mol
Flash Point: 149.8±27.9 °C
Index of Refraction: 1.503
Molar Refractivity: 69.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 135.51
ACD/KOC (pH 5.5): 1168.65
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 135.51
ACD/KOC (pH 7.4): 1168.65
Polar Surface Area: 43 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 37.6±5.0 dyne/cm
Molar Volume: 234.3±5.0 cm3

Click to predict properties on the Chemicalize site


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