ChemSpider 2D Image | 3-Methyl(~2~H_2_)aniline | C7H7D2N

3-Methyl(2H2)aniline

  • Molecular FormulaC7H7D2N
  • Average mass109.165 Da
  • Monoisotopic mass109.086052 Da
  • ChemSpider ID57619040

  • Non-standard isotope - Non-standard isotope

More details:

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

3-Methyl(2H2)anilin [German] [ACD/IUPAC Name]
3-Methyl(2H2)aniline [ACD/IUPAC Name]
3-Méthyl(2H2)aniline [French] [ACD/IUPAC Name]
Benzenamine-d2, 3-methyl- [ACD/Index Name]
39274-91-4 [RN]
3-methylaniline-d2

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

Density: 1.0±0.1 g/cm3
Boiling Point: 203.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.0±3.0 kJ/mol
Flash Point: 85.6±0.0 °C
Index of Refraction: 1.568
Molar Refractivity: 35.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 6.60
ACD/KOC (pH 5.5): 128.65
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.67
ACD/KOC (pH 7.4): 149.49
Polar Surface Area: 26 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 108.0±3.0 cm3

Click to predict properties on the Chemicalize site


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