ChemSpider 2D Image | (3S)-1,3-Nonanediol | C9H20O2

(3S)-1,3-Nonanediol

  • Molecular FormulaC9H20O2
  • Average mass160.254 Da
  • Monoisotopic mass160.146332 Da
  • ChemSpider ID32787767

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-1,3-Nonandiol [German] [ACD/IUPAC Name]
(3S)-1,3-Nonanediol [ACD/IUPAC Name]
(3S)-1,3-Nonanediol [French] [ACD/IUPAC Name]
1,3-Nonanediol, (3S)- [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: 268.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.9±6.0 kJ/mol
Flash Point: 122.3±13.0 °C
Index of Refraction: 1.455
Molar Refractivity: 46.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 25.71
ACD/KOC (pH 5.5): 355.62
ACD/LogD (pH 7.4): 2.16
ACD/BCF (pH 7.4): 25.71
ACD/KOC (pH 7.4): 355.62
Polar Surface Area: 40 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 172.5±3.0 cm3

Click to predict properties on the Chemicalize site


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