ChemSpider 2D Image | (1R)-2-Acetoxy-1-phenylethyl acetate | C12H14O4

(1R)-2-Acetoxy-1-phenylethyl acetate

  • Molecular FormulaC12H14O4
  • Average mass222.237 Da
  • Monoisotopic mass222.089203 Da
  • ChemSpider ID30990767

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-2-Acetoxy-1-phenylethyl acetate [ACD/IUPAC Name]
(1R)-2-Acetoxy-1-phenylethyl-acetat [German] [ACD/IUPAC Name]
1,2-Ethanediol, 1-phenyl-, diacetate, (1R)- [ACD/Index Name]
Acétate de (1R)-2-acétoxy-1-phényléthyle [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: 304.6±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.5±3.0 kJ/mol
Flash Point: 146.7±20.7 °C
Index of Refraction: 1.502
Molar Refractivity: 57.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.79
ACD/KOC (pH 5.5): 203.56
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.79
ACD/KOC (pH 7.4): 203.56
Polar Surface Area: 53 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 196.0±3.0 cm3

Click to predict properties on the Chemicalize site


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