ChemSpider 2D Image | (2S)-1-(3-Fluoro-4-methoxyphenyl)-2-propanamine | C10H14FNO

(2S)-1-(3-Fluoro-4-methoxyphenyl)-2-propanamine

  • Molecular FormulaC10H14FNO
  • Average mass183.223 Da
  • Monoisotopic mass183.105942 Da
  • ChemSpider ID65335542

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(3-Fluor-4-methoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
(2S)-1-(3-Fluoro-4-methoxyphenyl)-2-propanamine [ACD/IUPAC Name]
(2S)-1-(3-Fluoro-4-méthoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 3-fluoro-4-methoxy-α-methyl-, (αS)- [ACD/Index Name]
(2S)-1-(3-fluoro-4-methoxyphenyl)propan-2-amine
1335891-26-3 [RN]
MFCD20458095

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

Density: 1.1±0.1 g/cm3
Boiling Point: 261.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.9±3.0 kJ/mol
Flash Point: 112.0±23.2 °C
Index of Refraction: 1.504
Molar Refractivity: 50.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): -1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.39
Polar Surface Area: 35 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 171.0±3.0 cm3

Click to predict properties on the Chemicalize site


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