ChemSpider 2D Image | (2S)-2-Amino-1-(2-methoxy-5-methylphenyl)-1-propanol | C11H17NO2

(2S)-2-Amino-1-(2-methoxy-5-methylphenyl)-1-propanol

  • Molecular FormulaC11H17NO2
  • Average mass195.258 Da
  • Monoisotopic mass195.125931 Da
  • ChemSpider ID72831012

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-2-Amino-1-(2-methoxy-5-methylphenyl)-1-propanol [German] [ACD/IUPAC Name]
(2S)-2-Amino-1-(2-methoxy-5-methylphenyl)-1-propanol [ACD/IUPAC Name]
(2S)-2-Amino-1-(2-méthoxy-5-méthylphényl)-1-propanol [French] [ACD/IUPAC Name]
Benzenemethanol, α-[(1S)-1-aminoethyl]-2-methoxy-5-methyl- [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: 346.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 163.5±27.9 °C
Index of Refraction: 1.541
Molar Refractivity: 57.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -1.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.41
Polar Surface Area: 55 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

Click to predict properties on the Chemicalize site


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