ChemSpider 2D Image | (2R,5S)-1,4-Dioxane-2,5-diyldimethanamine | C6H14N2O2

(2R,5S)-1,4-Dioxane-2,5-diyldimethanamine

  • Molecular FormulaC6H14N2O2
  • Average mass146.188 Da
  • Monoisotopic mass146.105530 Da
  • ChemSpider ID32982213
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2R,5S)-1,4-Dioxan-2,5-diyldimethanamin [German] [ACD/IUPAC Name]
(2R,5S)-1,4-Dioxane-2,5-diyldimethanamine [ACD/IUPAC Name]
(2R,5S)-1,4-Dioxane-2,5-diyldiméthanamine [French] [ACD/IUPAC Name]
1,4-Dioxane-2,5-dimethanamine, (2R,5S)- [ACD/Index Name]
1-[(2R,5S)-5-(aminomethyl)-1,4-dioxan-2-yl]methanamine
71938-28-8 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 258.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.6±3.0 kJ/mol
Flash Point: 123.4±14.1 °C
Index of Refraction: 1.464
Molar Refractivity: 38.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.64
ACD/LogD (pH 5.5): -5.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 71 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 138.0±3.0 cm3

Click to predict properties on the Chemicalize site






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