ChemSpider 2D Image | 4-(~2~H_3_)Methyl-2-(2-methyl-2-propanyl)phenol | C11H13D3O

4-(2H3)Methyl-2-(2-methyl-2-propanyl)phenol

  • Molecular FormulaC11H13D3O
  • Average mass167.263 Da
  • Monoisotopic mass167.138947 Da
  • ChemSpider ID107435944

  • Non-standard isotope - Non-standard isotope

More details:

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

4-(2H3)Methyl-2-(2-methyl-2-propanyl)phenol [German] [ACD/IUPAC Name]
4-(2H3)Methyl-2-(2-methyl-2-propanyl)phenol [ACD/IUPAC Name]
4-(2H3)Méthyl-2-(2-méthyl-2-propanyl)phénol [French] [ACD/IUPAC Name]
Phenol, 2-(1,1-dimethylethyl)-4-(methyl-d3)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 237.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 100.0±0.0 °C
Index of Refraction: 1.513
Molar Refractivity: 51.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 364.86
ACD/KOC (pH 5.5): 2374.51
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 364.84
ACD/KOC (pH 7.4): 2374.38
Polar Surface Area: 20 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 32.5±3.0 dyne/cm
Molar Volume: 170.8±3.0 cm3

Click to predict properties on the Chemicalize site


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