ChemSpider 2D Image | (1E)-(1-~2~H_1_)-1,3-Butadiene | C4H5D

(1E)-(1-2H1)-1,3-Butadiene

  • Molecular FormulaC4H5D
  • Average mass55.097 Da
  • Monoisotopic mass55.053226 Da
  • ChemSpider ID74085281

  • Non-standard isotope - Non-standard isotope

More details:

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

(1E)-(1-2H1)-1,3-Butadien [German] [ACD/IUPAC Name]
(1E)-(1-2H1)-1,3-Butadiene [ACD/IUPAC Name]
(1E)-(1-2H1)-1,3-Butadiène [French] [ACD/IUPAC Name]
1,3-Butadiene-1-d, (1E)- [ACD/Index Name]

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

Density: 0.6±0.1 g/cm3
Boiling Point: -4.4±0.0 °C at 760 mmHg
Vapour Pressure: 2101.8±0.0 mmHg at 25°C
Enthalpy of Vaporization: 22.5±0.0 kJ/mol
Flash Point: -76.1±0.0 °C
Index of Refraction: 1.389
Molar Refractivity: 20.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.51
ACD/KOC (pH 5.5): 291.92
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.51
ACD/KOC (pH 7.4): 291.92
Polar Surface Area: 0 Å2
Polarizability: 7.9±0.5 10-24cm3
Surface Tension: 15.9±3.0 dyne/cm
Molar Volume: 84.8±3.0 cm3

Click to predict properties on the Chemicalize site


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