ChemSpider 2D Image | (1R,3S,8aR)-3-Ethynyloctahydro-1-indolizinol | C10H15NO

(1R,3S,8aR)-3-Ethynyloctahydro-1-indolizinol

  • Molecular FormulaC10H15NO
  • Average mass165.232 Da
  • Monoisotopic mass165.115356 Da
  • ChemSpider ID30653098

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,3S,8aR)-3-Ethinyloctahydro-1-indolizinol [German] [ACD/IUPAC Name]
(1R,3S,8aR)-3-Ethynyloctahydro-1-indolizinol [ACD/IUPAC Name]
(1R,3S,8aR)-3-Éthynyloctahydro-1-indolizinol [French] [ACD/IUPAC Name]
1-Indolizinol, 3-ethynyloctahydro-, (1R,3S,8aR)- [ACD/Index Name]
1126784-69-7 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 253.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 57.0±6.0 kJ/mol
Flash Point: 113.0±26.0 °C
Index of Refraction: 1.557
Molar Refractivity: 47.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): -0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 1.53
ACD/KOC (pH 7.4): 33.18
Polar Surface Area: 23 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 147.3±5.0 cm3

Click to predict properties on the Chemicalize site


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