ChemSpider 2D Image | 4-[2-(~2~H_2_)Amino(2,2-~2~H_2_)ethyl]-2-methoxyphenol | C9H9D4NO2

4-[2-(2H2)Amino(2,2-2H2)ethyl]-2-methoxyphenol

  • Molecular FormulaC9H9D4NO2
  • Average mass171.230 Da
  • Monoisotopic mass171.119736 Da
  • ChemSpider ID67155100

  • Non-standard isotope - Non-standard isotope

More details:

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

4-[2-(2H2)Amino(2,2-2H2)ethyl]-2-methoxyphenol [German] [ACD/IUPAC Name]
4-[2-(2H2)Amino(2,2-2H2)ethyl]-2-methoxyphenol [ACD/IUPAC Name]
4-[2-(2H2)Amino(2,2-2H2)éthyl]-2-méthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 4-[2-(amino-d2)ethyl-2,2-d2]-2-methoxy- [ACD/Index Name]
3-methoxy tyramine-d4

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

Density: 1.1±0.1 g/cm3
Boiling Point: 304.5±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.7±3.0 kJ/mol
Flash Point: 137.9±23.7 °C
Index of Refraction: 1.559
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -2.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 148.4±3.0 cm3

Click to predict properties on the Chemicalize site


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