ChemSpider 2D Image | (1S,2R)-1-(2-Methoxy-5-methylphenyl)-2-(methylamino)-1-propanol | C12H19NO2

(1S,2R)-1-(2-Methoxy-5-methylphenyl)-2-(methylamino)-1-propanol

  • Molecular FormulaC12H19NO2
  • Average mass209.285 Da
  • Monoisotopic mass209.141586 Da
  • ChemSpider ID110577147

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2R)-1-(2-Methoxy-5-methylphenyl)-2-(methylamino)-1-propanol [German] [ACD/IUPAC Name]
(1S,2R)-1-(2-Methoxy-5-methylphenyl)-2-(methylamino)-1-propanol [ACD/IUPAC Name]
(1S,2R)-1-(2-Méthoxy-5-méthylphényl)-2-(méthylamino)-1-propanol [French] [ACD/IUPAC Name]
Benzenemethanol, 2-methoxy-5-methyl-α-[(1R)-1-(methylamino)ethyl]-, (αS)- [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: 340.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 159.9±27.9 °C
Index of Refraction: 1.520
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -1.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.11
Polar Surface Area: 41 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 36.4±3.0 dyne/cm
Molar Volume: 203.0±3.0 cm3

Click to predict properties on the Chemicalize site


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