ChemSpider 2D Image | (1S,2R,4aR,5S,8aS)-1,5-Bis(hydroxymethyl)-2,5,8a-trimethyldecahydro-2-naphthalenol | C15H28O3

(1S,2R,4aR,5S,8aS)-1,5-Bis(hydroxymethyl)-2,5,8a-trimethyldecahydro-2-naphthalenol

  • Molecular FormulaC15H28O3
  • Average mass256.381 Da
  • Monoisotopic mass256.203857 Da
  • ChemSpider ID28668644

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S,2R,4aR,5S,8aS)-1,5-Bis(hydroxyméthyl)-2,5,8a-triméthyldécahydro-2-naphtalénol [French] [ACD/IUPAC Name]
(1S,2R,4aR,5S,8aS)-1,5-Bis(hydroxymethyl)-2,5,8a-trimethyldecahydro-2-naphthalenol [ACD/IUPAC Name]
(1S,2R,4aR,5S,8aS)-1,5-Bis(hydroxymethyl)-2,5,8a-trimethyldecahydro-2-naphthalinol [German] [ACD/IUPAC Name]
1,5-Naphthalenedimethanol, decahydro-6-hydroxy-1,4a,6-trimethyl-, (1S,4aS,5S,6R,8aR)- [ACD/Index Name]
diaporol C

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

Density: 1.0±0.1 g/cm3
Boiling Point: 380.0±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.7±6.0 kJ/mol
Flash Point: 173.0±12.8 °C
Index of Refraction: 1.502
Molar Refractivity: 72.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 18.49
ACD/KOC (pH 5.5): 280.84
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 18.49
ACD/KOC (pH 7.4): 280.84
Polar Surface Area: 61 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 244.2±3.0 cm3

Click to predict properties on the Chemicalize site


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