ChemSpider 2D Image | 4-TERT-BUTYL-D9-PHENOL | C10H5D9O

4-TERT-BUTYL-D9-PHENOL

  • Molecular FormulaC10H5D9O
  • Average mass159.273 Da
  • Monoisotopic mass159.160950 Da
  • ChemSpider ID32820543

  • Non-standard isotope - Non-standard isotope

More details:

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

358730-87-7 [RN]
4-[2-(2H3)Methyl(2H6)-2-propanyl]phenol [German] [ACD/IUPAC Name]
4-[2-(2H3)Methyl(2H6)-2-propanyl]phenol [ACD/IUPAC Name]
4-[2-(2H3)Méthyl(2H6)-2-propanyl]phénol [French] [ACD/IUPAC Name]
4-TERT-BUTYL-D9-PHENOL
Phenol, 4-[1,1-di(methyl-d3)ethyl-2,2,2-d3]- [ACD/Index Name]
Phenol, 4-[1,1-di(methyl-d3)ethyl-2,2,2-d3]-

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

Density: 1.0±0.1 g/cm3
Boiling Point: 233.7±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.0±3.0 kJ/mol
Flash Point: 110.9±8.2 °C
Index of Refraction: 1.514
Molar Refractivity: 46.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 209.06
ACD/KOC (pH 5.5): 1593.85
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 208.67
ACD/KOC (pH 7.4): 1590.94
Polar Surface Area: 20 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 154.6±3.0 cm3

Click to predict properties on the Chemicalize site


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