ChemSpider 2D Image | (2,2-~2~H_2_)Propanal | C3H4D2O

(2,2-2H2)Propanal

  • Molecular FormulaC3H4D2O
  • Average mass60.091 Da
  • Monoisotopic mass60.054417 Da
  • ChemSpider ID24532894
  • Non-standard isotope - Non-standard isotope


More details:






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

(2,2-2H2)Propanal [ACD/IUPAC Name]
(2,2-2H2)Propanal [German] [ACD/IUPAC Name]
(2,2-2H2)Propanal [French] [ACD/IUPAC Name]
Propanal-2,2-d2 [ACD/Index Name]
39493-21-5 [RN]
Propionaldehyde-2,2-d2

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

Density: 0.8±0.1 g/cm3
Boiling Point: 49.3±3.0 °C at 760 mmHg
Vapour Pressure: 299.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 28.3±0.0 kJ/mol
Flash Point: -25.9±6.0 °C
Index of Refraction: 1.348
Molar Refractivity: 16.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 49.26
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.63
ACD/KOC (pH 7.4): 49.26
Polar Surface Area: 17 Å2
Polarizability: 6.4±0.5 10-24cm3
Surface Tension: 20.5±3.0 dyne/cm
Molar Volume: 75.4±3.0 cm3

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