ChemSpider 2D Image | (2S)-1-(2-Bromo-4,6-dimethoxyphenyl)-2-propanamine | C11H16BrNO2

(2S)-1-(2-Bromo-4,6-dimethoxyphenyl)-2-propanamine

  • Molecular FormulaC11H16BrNO2
  • Average mass274.154 Da
  • Monoisotopic mass273.036438 Da
  • ChemSpider ID65783900

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(2-Brom-4,6-dimethoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
(2S)-1-(2-Bromo-4,6-dimethoxyphenyl)-2-propanamine [ACD/IUPAC Name]
(2S)-1-(2-Bromo-4,6-diméthoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2-bromo-4,6-dimethoxy-α-methyl-, (αS)- [ACD/Index Name]
(2S)-1-(2-bromo-4,6-dimethoxyphenyl)propan-2-amine
2227700-44-7 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 334.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.7±3.0 kJ/mol
Flash Point: 155.8±26.5 °C
Index of Refraction: 1.540
Molar Refractivity: 65.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.67
Polar Surface Area: 44 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 207.0±3.0 cm3

Click to predict properties on the Chemicalize site


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