ChemSpider 2D Image | Methyl diphenyl(2-propyn-1-yloxy)acetate | C18H16O3

Methyl diphenyl(2-propyn-1-yloxy)acetate

  • Molecular FormulaC18H16O3
  • Average mass280.318 Da
  • Monoisotopic mass280.109955 Da
  • ChemSpider ID30657533

More details:

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

Benzeneacetic acid, α-phenyl-α-(2-propyn-1-yloxy)-, methyl ester [ACD/Index Name]
Diphényl(2-propyn-1-yloxy)acétate de méthyle [French] [ACD/IUPAC Name]
Methyl diphenyl(2-propyn-1-yloxy)acetate [ACD/IUPAC Name]
Methyl-diphenyl(2-propin-1-yloxy)acetat [German] [ACD/IUPAC Name]
30118-97-9 [RN]
α-Phenyl-α-(2-propyn-1-yloxy)-benzeneacetic Acid Methyl Ester

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

Density: 1.1±0.1 g/cm3
Boiling Point: 413.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 175.6±21.9 °C
Index of Refraction: 1.561
Molar Refractivity: 79.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 5.00
ACD/BCF (pH 5.5): 3744.04
ACD/KOC (pH 5.5): 12571.63
ACD/LogD (pH 7.4): 5.00
ACD/BCF (pH 7.4): 3744.04
ACD/KOC (pH 7.4): 12571.63
Polar Surface Area: 36 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 43.8±3.0 dyne/cm
Molar Volume: 245.8±3.0 cm3

Click to predict properties on the Chemicalize site


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