ChemSpider 2D Image | Methyl 2-(1,3,5-trihydroxy-4a-methyl-8-oxodecahydro-2-naphthalenyl)acrylate | C15H22O6

Methyl 2-(1,3,5-trihydroxy-4a-methyl-8-oxodecahydro-2-naphthalenyl)acrylate

  • Molecular FormulaC15H22O6
  • Average mass298.332 Da
  • Monoisotopic mass298.141632 Da
  • ChemSpider ID22936712

More details:

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

2-(1,3,5-Trihydroxy-4a-méthyl-8-oxodécahydro-2-naphtalényl)acrylate de méthyle [French] [ACD/IUPAC Name]
2-Naphthaleneacetic acid, decahydro-1,3,5-trihydroxy-4a-methyl-α-methylene-8-oxo-, methyl ester [ACD/Index Name]
Methyl 2-(1,3,5-trihydroxy-4a-methyl-8-oxodecahydro-2-naphthalenyl)acrylate [ACD/IUPAC Name]
Methyl-2-(1,3,5-trihydroxy-4a-methyl-8-oxodecahydro-2-naphthalinyl)acrylat [German] [ACD/IUPAC Name]
Compound NP-015475
Methyl 2-(1,3,5-trihydroxy-4a-methyl-8-oxo-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)prop-2-enoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 440.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±6.0 kJ/mol
Flash Point: 159.2±22.2 °C
Index of Refraction: 1.563
Molar Refractivity: 73.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.15
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.86
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.86
Polar Surface Area: 104 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 226.2±3.0 cm3

Click to predict properties on the Chemicalize site


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