ChemSpider 2D Image | (2S)-N-(2-Iodoethyl)-1,4-dioxane-2-carboxamide | C7H12INO3

(2S)-N-(2-Iodoethyl)-1,4-dioxane-2-carboxamide

  • Molecular FormulaC7H12INO3
  • Average mass285.079 Da
  • Monoisotopic mass284.986176 Da
  • ChemSpider ID97460546

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-N-(2-Iodethyl)-1,4-dioxan-2-carboxamid [German] [ACD/IUPAC Name]
(2S)-N-(2-Iodoethyl)-1,4-dioxane-2-carboxamide [ACD/IUPAC Name]
(2S)-N-(2-Iodoéthyl)-1,4-dioxane-2-carboxamide [French] [ACD/IUPAC Name]
1,4-Dioxane-2-carboxamide, N-(2-iodoethyl)-, (2S)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 423.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 209.8±28.7 °C
Index of Refraction: 1.548
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.00
ACD/LogD (pH 5.5): -0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.07
ACD/LogD (pH 7.4): -0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.07
Polar Surface Area: 48 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 163.9±3.0 cm3

Click to predict properties on the Chemicalize site


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