ChemSpider 2D Image | (2S)-2-Chloro-2-phenylethanamine | C8H10ClN

(2S)-2-Chloro-2-phenylethanamine

  • Molecular FormulaC8H10ClN
  • Average mass155.625 Da
  • Monoisotopic mass155.050171 Da
  • ChemSpider ID75100862

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Chlor-2-phenylethanamin [German] [ACD/IUPAC Name]
(2S)-2-Chloro-2-phenylethanamine [ACD/IUPAC Name]
(2S)-2-Chloro-2-phényléthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, β-chloro-, (βS)- [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: 227.2±28.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.4±3.0 kJ/mol
Flash Point: 91.2±24.0 °C
Index of Refraction: 1.553
Molar Refractivity: 44.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.47
ACD/LogD (pH 5.5): -0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.08
ACD/KOC (pH 7.4): 39.18
Polar Surface Area: 26 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 138.1±3.0 cm3

Click to predict properties on the Chemicalize site


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