ChemSpider 2D Image | 2-[(1S)-1-Hydroxy-2-(methylamino)ethyl]phenol | C9H13NO2

2-[(1S)-1-Hydroxy-2-(methylamino)ethyl]phenol

  • Molecular FormulaC9H13NO2
  • Average mass167.205 Da
  • Monoisotopic mass167.094635 Da
  • ChemSpider ID75153574

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(1S)-1-Hydroxy-2-(methylamino)ethyl]phenol [German] [ACD/IUPAC Name]
2-[(1S)-1-Hydroxy-2-(methylamino)ethyl]phenol [ACD/IUPAC Name]
2-[(1S)-1-Hydroxy-2-(méthylamino)éthyl]phénol [French] [ACD/IUPAC Name]
Benzenemethanol, 2-hydroxy-α-[(methylamino)methyl]-, (αS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 341.1±27.0 °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: 163.4±14.3 °C
Index of Refraction: 1.572
Molar Refractivity: 47.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.03
ACD/LogD (pH 5.5): -3.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 52 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 144.3±3.0 cm3

Click to predict properties on the Chemicalize site


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