ChemSpider 2D Image | N-{4-[(1R,2R)-2-Amino-1,3-dihydroxypropyl]phenyl}acetamide | C11H16N2O3

N-{4-[(1R,2R)-2-Amino-1,3-dihydroxypropyl]phenyl}acetamide

  • Molecular FormulaC11H16N2O3
  • Average mass224.256 Da
  • Monoisotopic mass224.116089 Da
  • ChemSpider ID65514811

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acetamide, N-[4-[(1R,2R)-2-amino-1,3-dihydroxypropyl]phenyl]- [ACD/Index Name]
N-{4-[(1R,2R)-2-Amino-1,3-dihydroxypropyl]phenyl}acetamid [German] [ACD/IUPAC Name]
N-{4-[(1R,2R)-2-Amino-1,3-dihydroxypropyl]phenyl}acetamide [ACD/IUPAC Name]
N-{4-[(1R,2R)-2-Amino-1,3-dihydroxypropyl]phényl}acétamide [French] [ACD/IUPAC Name]
2137026-21-0 [RN]
MFCD30733544

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

Density: 1.3±0.1 g/cm3
Boiling Point: 537.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 278.6±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 61.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.74
ACD/LogD (pH 5.5): -3.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 171.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement