ChemSpider 2D Image | Ethyl (2R)-2-acetylheptanoate | C11H20O3

Ethyl (2R)-2-acetylheptanoate

  • Molecular FormulaC11H20O3
  • Average mass200.275 Da
  • Monoisotopic mass200.141251 Da
  • ChemSpider ID21428022

More details:

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

(2R)-2-Acétylheptanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl (2R)-2-acetylheptanoate [ACD/IUPAC Name]
Ethyl-(2R)-2-acetylheptanoat [German] [ACD/IUPAC Name]
Heptanoic acid, 2-acetyl-, ethyl ester, (2R)- [ACD/Index Name]
24317-94-0 [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: 240.4±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.7±3.0 kJ/mol
Flash Point: 95.5±18.5 °C
Index of Refraction: 1.432
Molar Refractivity: 54.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 101.12
ACD/KOC (pH 5.5): 947.69
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.11
ACD/KOC (pH 7.4): 947.67
Polar Surface Area: 43 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 30.7±3.0 dyne/cm
Molar Volume: 211.1±3.0 cm3

Click to predict properties on the Chemicalize site


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