ChemSpider 2D Image | 3-Butyl-5-methoxy-1H-inden-1-yl acetate | C16H20O3

3-Butyl-5-methoxy-1H-inden-1-yl acetate

  • Molecular FormulaC16H20O3
  • Average mass260.328 Da
  • Monoisotopic mass260.141235 Da
  • ChemSpider ID26994369

More details:

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

1H-Inden-1-ol, 3-butyl-5-methoxy-, acetate [ACD/Index Name]
3-Butyl-5-methoxy-1H-inden-1-yl acetate [ACD/IUPAC Name]
3-Butyl-5-methoxy-1H-inden-1-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 3-butyl-5-méthoxy-1H-indén-1-yle [French] [ACD/IUPAC 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: 378.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.6±3.0 kJ/mol
Flash Point: 158.9±22.5 °C
Index of Refraction: 1.537
Molar Refractivity: 74.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 709.94
ACD/KOC (pH 5.5): 3823.91
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 709.94
ACD/KOC (pH 7.4): 3823.91
Polar Surface Area: 36 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 40.3±5.0 dyne/cm
Molar Volume: 237.7±5.0 cm3

Click to predict properties on the Chemicalize site


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