ChemSpider 2D Image | 1-[4-(~2~H_3_)Methyl(~2~H_4_)phenyl]-1-propanone | C10H5D7O

1-[4-(2H3)Methyl(2H4)phenyl]-1-propanone

  • Molecular FormulaC10H5D7O
  • Average mass155.245 Da
  • Monoisotopic mass155.132751 Da
  • ChemSpider ID26568813

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[4-(2H3)Methyl(2H4)phenyl]-1-propanon [German] [ACD/IUPAC Name]
1-[4-(2H3)Methyl(2H4)phenyl]-1-propanone [ACD/IUPAC Name]
1-[4-(2H3)Méthyl(2H4)phényl]-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[4-(methyl-d3)phenyl-2,3,5,6-d4]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 238.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 96.1±0.0 °C
Index of Refraction: 1.507
Molar Refractivity: 45.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 63.90
ACD/KOC (pH 5.5): 682.30
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 63.90
ACD/KOC (pH 7.4): 682.30
Polar Surface Area: 17 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 153.7±3.0 cm3

Click to predict properties on the Chemicalize site


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