ChemSpider 2D Image | (2S)-1-(4-Chlorophenyl)-N-hydroxy-2-propanamine | C9H12ClNO

(2S)-1-(4-Chlorophenyl)-N-hydroxy-2-propanamine

  • Molecular FormulaC9H12ClNO
  • Average mass185.651 Da
  • Monoisotopic mass185.060745 Da
  • ChemSpider ID97473872

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(4-Chlorophenyl)-N-hydroxy-2-propanamine [ACD/IUPAC Name]
(2S)-1-(4-Chlorophényl)-N-hydroxy-2-propanamine [French] [ACD/IUPAC Name]
(2S)-1-(4-Chlorphenyl)-N-hydroxy-2-propanamin [German] [ACD/IUPAC Name]
Benzeneethanamine, 4-chloro-N-hydroxy-α-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: 309.5±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.1±3.0 kJ/mol
Flash Point: 141.0±28.4 °C
Index of Refraction: 1.554
Molar Refractivity: 50.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 10.32
ACD/KOC (pH 5.5): 139.00
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.60
ACD/KOC (pH 7.4): 371.83
Polar Surface Area: 32 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 157.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement