ChemSpider 2D Image | 4-Methyl-2,6-bis[(~2~H_3_)methyloxy]phenol | C9H6D6O3

4-Methyl-2,6-bis[(2H3)methyloxy]phenol

  • Molecular FormulaC9H6D6O3
  • Average mass174.227 Da
  • Monoisotopic mass174.116302 Da
  • ChemSpider ID107440823

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Methyl-2,6-bis[(2H3)methyloxy]phenol [German] [ACD/IUPAC Name]
4-Methyl-2,6-bis[(2H3)methyloxy]phenol [ACD/IUPAC Name]
4-Méthyl-2,6-bis[(2H3)méthyloxy]phénol [French] [ACD/IUPAC Name]
Phenol, 4-methyl-2,6-bis(methyl-d3-oxy)- [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: 268.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 116.1±25.9 °C
Index of Refraction: 1.521
Molar Refractivity: 46.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 10.25
ACD/KOC (pH 5.5): 184.15
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 10.24
ACD/KOC (pH 7.4): 183.92
Polar Surface Area: 39 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 152.1±3.0 cm3

Click to predict properties on the Chemicalize site


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