ChemSpider 2D Image | (1R,2S)-1-Chloro-N-methyl-1-phenyl-2-propanamine | C10H14ClN

(1R,2S)-1-Chloro-N-methyl-1-phenyl-2-propanamine

  • Molecular FormulaC10H14ClN
  • Average mass183.678 Da
  • Monoisotopic mass183.081482 Da
  • ChemSpider ID57646658

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S)-1-Chlor-N-methyl-1-phenyl-2-propanamin [German] [ACD/IUPAC Name]
(1R,2S)-1-Chloro-N-methyl-1-phenyl-2-propanamine [ACD/IUPAC Name]
(1R,2S)-1-Chloro-N-méthyl-1-phényl-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, β-chloro-N,α-dimethyl-, (αS,βR)- [ACD/Index Name]
(-)-Chloroephedrine
(aS,�R)-�-Chloro-N,a-dimethylbenzeneethanamine
110925-64-9 [RN]
Benzeneethanamine, �-chloro-N,a-dimethyl-, [R-(R*,S*)]-
Chloroephedrine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 251.9±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.9±3.0 kJ/mol
Flash Point: 106.1±24.0 °C
Index of Refraction: 1.518
Molar Refractivity: 53.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.34
ACD/KOC (pH 7.4): 16.46
Polar Surface Area: 12 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 33.8±3.0 dyne/cm
Molar Volume: 176.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement