ChemSpider 2D Image | Goniodiol 7-acetate | C19H29IO2

Goniodiol 7-acetate

  • Molecular FormulaC19H29IO2
  • Average mass416.337 Da
  • Monoisotopic mass416.121216 Da
  • ChemSpider ID29365168

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

3-Iodgonan-3-yl-acetat [German] [ACD/IUPAC Name]
3-Iodogonan-3-yl acetate [ACD/IUPAC Name]
96422-53-6 [RN]
Acétate de 3-iodogonan-3-yle [French] [ACD/IUPAC Name]
Gonan-3-ol, 3-iodo-, acetate [ACD/Index Name]
Goniodiol 7-acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 433.2±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 215.8±24.0 °C
Index of Refraction: 1.572
Molar Refractivity: 96.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.00
ACD/LogD (pH 5.5): 6.38
ACD/BCF (pH 5.5): 41291.93
ACD/KOC (pH 5.5): 70084.13
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41291.93
ACD/KOC (pH 7.4): 70084.13
Polar Surface Area: 26 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 44.8±5.0 dyne/cm
Molar Volume: 293.2±5.0 cm3

Click to predict properties on the Chemicalize site


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