ChemSpider 2D Image | 3,3-Dimethyl(1,1,2-~2~H_3_)-1-butene | C6H9D3

3,3-Dimethyl(1,1,2-2H3)-1-butene

  • Molecular FormulaC6H9D3
  • Average mass87.178 Da
  • Monoisotopic mass87.112732 Da
  • ChemSpider ID73948550

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Butene-1,1,2-d3, 3,3-dimethyl- [ACD/Index Name]
3,3-Dimethyl(1,1,2-2H3)-1-buten [German] [ACD/IUPAC Name]
3,3-Dimethyl(1,1,2-2H3)-1-butene [ACD/IUPAC Name]
3,3-Diméthyl(1,1,2-2H3)-1-butène [French] [ACD/IUPAC Name]

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

Density: 0.7±0.1 g/cm3
Boiling Point: 41.2±0.0 °C at 760 mmHg
Vapour Pressure: 422.3±0.0 mmHg at 25°C
Enthalpy of Vaporization: 27.4±0.8 kJ/mol
Flash Point: -28.9±0.0 °C
Index of Refraction: 1.397
Molar Refractivity: 29.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 90.34
ACD/KOC (pH 5.5): 874.24
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 90.34
ACD/KOC (pH 7.4): 874.24
Polar Surface Area: 0 Å2
Polarizability: 11.7±0.5 10-24cm3
Surface Tension: 18.6±3.0 dyne/cm
Molar Volume: 122.7±3.0 cm3

Click to predict properties on the Chemicalize site


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