ChemSpider 2D Image | (1S,2R,5R,7S)-2-Isopropyl-5,8-dimethyl-11-oxatricyclo[6.2.1.0~1,5~]undecan-7-ol | C15H26O2

(1S,2R,5R,7S)-2-Isopropyl-5,8-dimethyl-11-oxatricyclo[6.2.1.01,5]undecan-7-ol

  • Molecular FormulaC15H26O2
  • Average mass238.366 Da
  • Monoisotopic mass238.193283 Da
  • ChemSpider ID58818334

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(1S,2R,5R,7S)-2-Isopropyl-5,8-dimethyl-11-oxatricyclo[6.2.1.01,5]undecan-7-ol [German] [ACD/IUPAC Name]
(1S,2R,5R,7S)-2-Isopropyl-5,8-dimethyl-11-oxatricyclo[6.2.1.01,5]undecan-7-ol [ACD/IUPAC Name]
(1S,2R,5R,7S)-2-Isopropyl-5,8-diméthyl-11-oxatricyclo[6.2.1.01,5]undécan-7-ol [French] [ACD/IUPAC Name]
1H-3a,6-Epoxyazulen-7-ol, octahydro-6,8a-dimethyl-3-(1-methylethyl)-, (3R,3aS,7S,8aR)- [ACD/Index Name]
887-08-1 [RN]
Daucol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 290.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 61.5±6.0 kJ/mol
Flash Point: 102.3±12.7 °C
Index of Refraction: 1.518
Molar Refractivity: 68.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 63.81
ACD/KOC (pH 5.5): 681.62
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 63.81
ACD/KOC (pH 7.4): 681.62
Polar Surface Area: 29 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 38.0±5.0 dyne/cm
Molar Volume: 226.5±5.0 cm3

Click to predict properties on the Chemicalize site


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