ChemSpider 2D Image | 4-Methyl-2-propyltetrahydro-2H-pyran-4-yl acetate | C11H20O3

4-Methyl-2-propyltetrahydro-2H-pyran-4-yl acetate

  • Molecular FormulaC11H20O3
  • Average mass200.275 Da
  • Monoisotopic mass200.141251 Da
  • ChemSpider ID23349556

More details:






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

2H-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, acetate [ACD/Index Name]
4-Methyl-2-propyltetrahydro-2H-pyran-4-yl acetate [ACD/IUPAC Name]
4-Methyl-2-propyltetrahydro-2H-pyran-4-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-méthyl-2-propyltétrahydro-2H-pyran-4-yle [French] [ACD/IUPAC Name]
T6OTJ B3 DOV1 D1 [WLN]
131766-73-9 [RN]
2H-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, 4-acetate [ACD/Index Name]
Clarycet [Trade name]

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

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 248.3±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.5±3.0 kJ/mol
Flash Point: 97.5±20.0 °C
Index of Refraction: 1.451
Molar Refractivity: 54.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 81.99
ACD/KOC (pH 5.5): 815.61
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 81.99
ACD/KOC (pH 7.4): 815.61
Polar Surface Area: 36 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 31.9±5.0 dyne/cm
Molar Volume: 202.4±5.0 cm3

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