ChemSpider 2D Image | 2-Acetoxy-2-methylpropyl 3-oxobutanoate | C10H16O5

2-Acetoxy-2-methylpropyl 3-oxobutanoate

  • Molecular FormulaC10H16O5
  • Average mass216.231 Da
  • Monoisotopic mass216.099777 Da
  • ChemSpider ID21896857

More details:

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

106685-66-9 [RN]
2-Acetoxy-2-methylpropyl 3-oxobutanoate [ACD/IUPAC Name]
2-Acetoxy-2-methylpropyl-3-oxobutanoat [German] [ACD/IUPAC Name]
3-Oxobutanoate de 2-acétoxy-2-méthylpropyle [French] [ACD/IUPAC Name]
3-Oxobutanoic Acid 2-Acetoxy-2-methylpropyl Ester
Butanoic acid, 3-oxo-, 2-(acetyloxy)-2-methylpropyl ester [ACD/Index Name]
(2-acetyloxy-2-methylpropyl) 3-oxobutanoate
1185147-99-2 [RN]
2-(Acetyloxy)-2-methylpropyl 3-oxobutanoate
3-Oxo-butanoic acid 2-(acetyloxy)-2-methylpropyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 280.6±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.9±3.0 kJ/mol
Flash Point: 118.4±20.4 °C
Index of Refraction: 1.438
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 2.35
ACD/KOC (pH 5.5): 64.12
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 2.35
ACD/KOC (pH 7.4): 64.06
Polar Surface Area: 70 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 197.7±3.0 cm3

Click to predict properties on the Chemicalize site


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