ChemSpider 2D Image | 3-[(2R)-2-Aminopropoxy]-2,4-dimethylphenol | C11H17NO2

3-[(2R)-2-Aminopropoxy]-2,4-dimethylphenol

  • Molecular FormulaC11H17NO2
  • Average mass195.258 Da
  • Monoisotopic mass195.125931 Da
  • ChemSpider ID30829861
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

3-[(2R)-2-Aminopropoxy]-2,4-dimethylphenol [German] [ACD/IUPAC Name]
3-[(2R)-2-Aminopropoxy]-2,4-dimethylphenol [ACD/IUPAC Name]
3-[(2R)-2-Aminopropoxy]-2,4-diméthylphénol [French] [ACD/IUPAC Name]
Phenol, 3-[(2R)-2-aminopropoxy]-2,4-dimethyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 329.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 153.3±27.9 °C
Index of Refraction: 1.543
Molar Refractivity: 57.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.12
Polar Surface Area: 55 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 181.5±3.0 cm3

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