ChemSpider 2D Image | (2,2-~2~H_2_)Butanal | C4H6D2O

(2,2-2H2)Butanal

  • Molecular FormulaC4H6D2O
  • Average mass74.118 Da
  • Monoisotopic mass74.070068 Da
  • ChemSpider ID24532287

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,2-2H2)Butanal [ACD/IUPAC Name]
(2,2-2H2)Butanal [German] [ACD/IUPAC Name]
(2,2-2H2)Butanal [French] [ACD/IUPAC Name]
Butanal-2,2-d2 [ACD/Index Name]
81214-92-8 [RN]
Butanal, Butyric aldehyde
n-Butyraldehyde-2,2-d2

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

Density: 0.8±0.1 g/cm3
Boiling Point: 77.6±3.0 °C at 760 mmHg
Vapour Pressure: 96.0±0.1 mmHg at 25°C
Enthalpy of Vaporization: 31.9±3.0 kJ/mol
Flash Point: -11.1±0.0 °C
Index of Refraction: 1.370
Molar Refractivity: 20.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 2.58
ACD/KOC (pH 5.5): 68.52
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.58
ACD/KOC (pH 7.4): 68.52
Polar Surface Area: 17 Å2
Polarizability: 8.2±0.5 10-24cm3
Surface Tension: 22.5±3.0 dyne/cm
Molar Volume: 91.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement