ChemSpider 2D Image | (2S)-1-(4-Aminophenoxy)-3-(isopropylamino)-2-propanol | C12H20N2O2

(2S)-1-(4-Aminophenoxy)-3-(isopropylamino)-2-propanol

  • Molecular FormulaC12H20N2O2
  • Average mass224.299 Da
  • Monoisotopic mass224.152481 Da
  • ChemSpider ID25033482

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(4-Aminophenoxy)-3-(isopropylamino)-2-propanol [German] [ACD/IUPAC Name]
(2S)-1-(4-Aminophenoxy)-3-(isopropylamino)-2-propanol [ACD/IUPAC Name]
(2S)-1-(4-Aminophénoxy)-3-(isopropylamino)-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-(4-aminophenoxy)-3-[(1-methylethyl)amino]-, (2S)- [ACD/Index 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: 407.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 200.0±25.9 °C
Index of Refraction: 1.550
Molar Refractivity: 65.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.28
ACD/LogD (pH 5.5): -2.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 68 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 43.8±3.0 dyne/cm
Molar Volume: 205.3±3.0 cm3

Click to predict properties on the Chemicalize site


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