ChemSpider 2D Image | Isobutyl 2,2-dimethylpentanoate | C11H22O2

Isobutyl 2,2-dimethylpentanoate

  • Molecular FormulaC11H22O2
  • Average mass186.291 Da
  • Monoisotopic mass186.161987 Da
  • ChemSpider ID35763135

More details:

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

2,2-Diméthylpentanoate d'isobutyle [French] [ACD/IUPAC Name]
Isobutyl 2,2-dimethylpentanoate [ACD/IUPAC Name]
Isobutyl-2,2-dimethylpentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 2,2-dimethyl-, 2-methylpropyl ester [ACD/Index Name]
20225-32-5 [RN]
2-Methylpropyl 2,2-dimethylpentanoate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 193.2±8.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.9±3.0 kJ/mol
Flash Point: 71.7±9.7 °C
Index of Refraction: 1.425
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 371.18
ACD/KOC (pH 5.5): 2403.87
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 371.18
ACD/KOC (pH 7.4): 2403.87
Polar Surface Area: 26 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 26.8±3.0 dyne/cm
Molar Volume: 214.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement