ChemSpider 2D Image | 3-Phenyl(1-~2~H)propanal | C9H9DO

3-Phenyl(1-2H)propanal

  • Molecular FormulaC9H9DO
  • Average mass135.181 Da
  • Monoisotopic mass135.079437 Da
  • ChemSpider ID62912495
  • Non-standard isotope - Non-standard isotope


More details:






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

3-Phenyl(1-2H)propanal [German] [ACD/IUPAC Name]
3-Phenyl(1-2H)propanal [ACD/IUPAC Name]
3-Phényl(1-2H)propanal [French] [ACD/IUPAC Name]
Benzenepropanal-d [ACD/Index Name]
29372-37-0 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 217.7±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.4±3.0 kJ/mol
Flash Point: 95.0±0.0 °C
Index of Refraction: 1.509
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.09
ACD/KOC (pH 5.5): 298.09
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.09
ACD/KOC (pH 7.4): 298.09
Polar Surface Area: 17 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 136.1±3.0 cm3

Click to predict properties on the Chemicalize site






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