ChemSpider 2D Image | 4-[1-(~2~H_5_)Phenylpropoxy]-2H-chromen-2-one | C18H11D5O3

4-[1-(2H5)Phenylpropoxy]-2H-chromen-2-one

  • Molecular FormulaC18H11D5O3
  • Average mass285.349 Da
  • Monoisotopic mass285.141327 Da
  • ChemSpider ID58784658

  • Non-standard isotope - Non-standard isotope

More details:

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

2H-1-Benzopyran-2-one, 4-[1-(phenyl-d5)propoxy]- [ACD/Index Name]
4-[1-(2H5)Phenylpropoxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
4-[1-(2H5)Phenylpropoxy]-2H-chromen-2-one [ACD/IUPAC Name]
4-[1-(2H5)Phénylpropoxy]-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 469.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.1±3.0 kJ/mol
Flash Point: 201.7±23.3 °C
Index of Refraction: 1.609
Molar Refractivity: 80.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 571.95
ACD/KOC (pH 5.5): 3275.82
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 571.95
ACD/KOC (pH 7.4): 3275.82
Polar Surface Area: 36 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 232.5±5.0 cm3

Click to predict properties on the Chemicalize site


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