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Search term: NUKLCVRWHABVOH (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(3-Methoxy-4-propoxyphenyl)-2-propanamine | C13H21NO2

1-(3-Methoxy-4-propoxyphenyl)-2-propanamine

  • Molecular FormulaC13H21NO2
  • Average mass223.311 Da
  • Monoisotopic mass223.157227 Da
  • ChemSpider ID26472478

More details:

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

1-(3-Methoxy-4-propoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
1-(3-Methoxy-4-propoxyphenyl)-2-propanamine [ACD/IUPAC Name]
1-(3-Méthoxy-4-propoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 3-methoxy-α-methyl-4-propoxy- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 321.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.3±3.0 kJ/mol
Flash Point: 162.2±31.0 °C
Index of Refraction: 1.506
Molar Refractivity: 66.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): -0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.59
Polar Surface Area: 44 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 223.8±3.0 cm3

Click to predict properties on the Chemicalize site


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