ChemSpider 2D Image | (2R,3S)-2-Ethyl-3-hydroxypentanal | C7H14O2

(2R,3S)-2-Ethyl-3-hydroxypentanal

  • Molecular FormulaC7H14O2
  • Average mass130.185 Da
  • Monoisotopic mass130.099380 Da
  • ChemSpider ID61410807

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-2-Ethyl-3-hydroxypentanal [German] [ACD/IUPAC Name]
(2R,3S)-2-Ethyl-3-hydroxypentanal [ACD/IUPAC Name]
(2R,3S)-2-Éthyl-3-hydroxypentanal [French] [ACD/IUPAC Name]
Pentanal, 2-ethyl-3-hydroxy-, (2R,3S)- [ACD/Index Name]
1621958-44-8 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 196.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 50.4±6.0 kJ/mol
Flash Point: 76.5±15.2 °C
Index of Refraction: 1.431
Molar Refractivity: 36.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.64
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 76.38
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 3.00
ACD/KOC (pH 7.4): 76.38
Polar Surface Area: 37 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 139.7±3.0 cm3

Click to predict properties on the Chemicalize site


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