ChemSpider 2D Image | 2-[(2R)-5-Acetyl-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl nonanoate | C22H30O4

2-[(2R)-5-Acetyl-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl nonanoate

  • Molecular FormulaC22H30O4
  • Average mass358.471 Da
  • Monoisotopic mass358.214417 Da
  • ChemSpider ID29419955

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(2R)-5-Acetyl-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl nonanoate [ACD/IUPAC Name]
2-[(2R)-5-Acetyl-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl-nonanoat [German] [ACD/IUPAC Name]
Nonanoate de 2-[(2R)-5-acétyl-2,3-dihydro-1-benzofuran-2-yl]-2-propén-1-yle [French] [ACD/IUPAC Name]
Nonanoic acid, 2-[(2R)-5-acetyl-2,3-dihydro-2-benzofuranyl]-2-propen-1-yl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 487.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 210.2±28.8 °C
Index of Refraction: 1.516
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 6.06
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 32759.48
ACD/KOC (pH 5.5): 59382.99
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32759.48
ACD/KOC (pH 7.4): 59382.99
Polar Surface Area: 53 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 39.0±3.0 dyne/cm
Molar Volume: 338.7±3.0 cm3

Click to predict properties on the Chemicalize site


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