ChemSpider 2D Image | [(4aS,8aS)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]methanol | C15H26O

[(4aS,8aS)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]methanol

  • Molecular FormulaC15H26O
  • Average mass222.366 Da
  • Monoisotopic mass222.198364 Da
  • ChemSpider ID95532629

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[(4aS,8aS)-2,5,5,8a-Tétraméthyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphtalényl]méthanol [French] [ACD/IUPAC Name]
[(4aS,8aS)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]methanol [ACD/IUPAC Name]
[(4aS,8aS)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalinyl]methanol [German] [ACD/IUPAC Name]
1-Naphthalenemethanol, 1,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl-, (4aS,8aS)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 298.8±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.5±6.0 kJ/mol
Flash Point: 106.9±15.0 °C
Index of Refraction: 1.480
Molar Refractivity: 68.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1949.80
ACD/KOC (pH 5.5): 7880.82
ACD/LogD (pH 7.4): 4.63
ACD/BCF (pH 7.4): 1949.80
ACD/KOC (pH 7.4): 7880.82
Polar Surface Area: 20 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 29.2±3.0 dyne/cm
Molar Volume: 241.4±3.0 cm3

Click to predict properties on the Chemicalize site


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