ChemSpider 2D Image | 3,4-Dimethyl(O-~2~H_4_)phenol | C8H6D4O

3,4-Dimethyl(O-2H4)phenol

  • Molecular FormulaC8H6D4O
  • Average mass126.189 Da
  • Monoisotopic mass126.098274 Da
  • ChemSpider ID24532481

  • Non-standard isotope - Non-standard isotope

More details:

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

3,4-Dimethyl(O-2H4)phenol [ACD/IUPAC Name]
3,4-Dimethyl(O-2H4)phenol [German] [ACD/IUPAC Name]
3,4-Diméthyl(O-2H4)phénol [French] [ACD/IUPAC Name]
Phenol-2,3,6-d3-d, 4,5-dimethyl- [ACD/Index Name]
1,3,4-Xylenol
1219803-55-0 [RN]
3,4-Dimethylphenol-2,5,6-d3,OD
4,5-Dimethylphenol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 226.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 48.2±3.0 kJ/mol
Flash Point: 94.0±7.2 °C
Index of Refraction: 1.540
Molar Refractivity: 37.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.56
ACD/KOC (pH 5.5): 457.53
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.52
ACD/KOC (pH 7.4): 457.05
Polar Surface Area: 20 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 120.4±3.0 cm3

Click to predict properties on the Chemicalize site


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