ChemSpider 2D Image | 1-Methyl-2-(~2~H_1_)methylbenzene | C8H9D

1-Methyl-2-(2H1)methylbenzene

  • Molecular FormulaC8H9D
  • Average mass107.171 Da
  • Monoisotopic mass107.084526 Da
  • ChemSpider ID67029742
  • Non-standard isotope - Non-standard isotope


More details:






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

1-Methyl-2-(2H1)methylbenzene [ACD/IUPAC Name]
1-Méthyl-2-(2H1)méthylbenzène [French] [ACD/IUPAC Name]
1-Methyl-2-(2H1)methylbenzol [German] [ACD/IUPAC Name]
Benzene, 1-methyl-2-(methyl-d)- [ACD/Index Name]
(methyl-d)-toluene

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 145.9±10.0 °C at 760 mmHg
Vapour Pressure: 6.0±0.1 mmHg at 25°C
Enthalpy of Vaporization: 36.2±0.0 kJ/mol
Flash Point: 32.2±0.0 °C
Index of Refraction: 1.500
Molar Refractivity: 35.9±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 173.90
ACD/KOC (pH 5.5): 1397.04
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 173.90
ACD/KOC (pH 7.4): 1397.04
Polar Surface Area: 0 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 28.8±3.0 dyne/cm
Molar Volume: 122.0±3.0 cm3

Click to predict properties on the Chemicalize site






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