ChemSpider 2D Image | N-(~2~H_3_)Methyl-N-[1-(4-nitrophenyl)-2-propanyl]-2-propyn-1-amine | C13H13D3N2O2

N-(2H3)Methyl-N-[1-(4-nitrophenyl)-2-propanyl]-2-propyn-1-amine

  • Molecular FormulaC13H13D3N2O2
  • Average mass235.297 Da
  • Monoisotopic mass235.140015 Da
  • ChemSpider ID78333939

  • Non-standard isotope - Non-standard isotope

More details:

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

Benzeneethanamine, α-methyl-N-(methyl-d3)-4-nitro-N-2-propyn-1-yl- [ACD/Index Name]
N-(2H3)Methyl-N-[1-(4-nitrophenyl)-2-propanyl]-2-propin-1-amin [German] [ACD/IUPAC Name]
N-(2H3)Methyl-N-[1-(4-nitrophenyl)-2-propanyl]-2-propyn-1-amine [ACD/IUPAC Name]
N-(2H3)Méthyl-N-[1-(4-nitrophényl)-2-propanyl]-2-propyn-1-amine [French] [ACD/IUPAC 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: 347.1±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.1±3.0 kJ/mol
Flash Point: 163.7±23.7 °C
Index of Refraction: 1.558
Molar Refractivity: 67.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 3.37
ACD/KOC (pH 5.5): 34.48
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 58.56
ACD/KOC (pH 7.4): 599.00
Polar Surface Area: 49 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 208.0±3.0 cm3

Click to predict properties on the Chemicalize site


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