ChemSpider 2D Image | 2,2-Dimethyl-3-[2-(~2~H_3_)methyl(3,3,3-~2~H_3_)-1-propen-1-yl]cyclopropanecarboxylic acid | C10H10D6O2

2,2-Dimethyl-3-[2-(2H3)methyl(3,3,3-2H3)-1-propen-1-yl]cyclopropanecarboxylic acid

  • Molecular FormulaC10H10D6O2
  • Average mass174.270 Da
  • Monoisotopic mass174.152695 Da
  • ChemSpider ID107441007

  • Non-standard isotope - Non-standard isotope

More details:

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

2,2-Dimethyl-3-[2-(2H3)methyl(3,3,3-2H3)-1-propen-1-yl]cyclopropancarbonsäure [German] [ACD/IUPAC Name]
2,2-Dimethyl-3-[2-(2H3)methyl(3,3,3-2H3)-1-propen-1-yl]cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide 2,2-diméthyl-3-[2-(2H3)méthyl(3,3,3-2H3)-1-propén-1-yl]cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2,2-dimethyl-3-[2-(methyl-d3)-1-propen-1-yl-3,3,3-d3]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 246.4±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 53.2±6.0 kJ/mol
Flash Point: 119.0±18.9 °C
Index of Refraction: 1.547
Molar Refractivity: 49.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 37.85
ACD/KOC (pH 5.5): 297.72
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.94
Polar Surface Area: 37 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 156.1±3.0 cm3

Click to predict properties on the Chemicalize site


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